#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o5j s LYS 3 N 0.00 1.79 -0.04 1.64 1.02 -1.26 -5.02 119.74 117.87 2o5j s LYS 3 Ca 0.00 1.21 -0.21 0.00 0.02 0.00 0.00 55.97 57.00 2o5j s LYS 3 Cb 0.00 -1.84 -0.05 0.00 -0.52 0.00 0.00 37.83 35.42 2o5j s LYS 3 CO 0.00 -1.99 0.60 -2.00 -0.92 0.00 0.00 175.35 171.04 2o5j s GLU 4 N -4.84 4.34 -0.37 1.68 2.12 -1.26 -5.03 118.70 115.35 2o5j s GLU 4 Ca 0.63 0.72 -0.29 0.00 0.36 0.00 0.00 54.97 56.39 2o5j s GLU 4 Cb -0.19 -3.38 -0.00 0.00 0.26 0.00 0.00 34.13 30.82 2o5j s GLU 4 CO 0.57 0.27 1.56 0.14 -0.54 0.00 0.00 175.26 177.25 2o5j s VAL 5 N 0.15 3.74 -0.14 3.70 -7.23 -1.26 -4.85 120.40 114.52 2o5j s VAL 5 Ca 0.32 0.76 0.04 0.00 -1.81 0.00 0.00 61.98 61.28 2o5j s VAL 5 Cb -0.18 -3.98 -0.04 0.00 0.56 0.00 0.00 36.38 32.74 2o5j s VAL 5 CO 0.16 -0.61 0.14 -1.14 -0.31 0.00 0.00 175.10 173.34 2o5j n ARG 6 N 8.17 4.77 -3.72 4.82 3.00 -1.26 -4.99 116.66 127.45 2o5j n ARG 6 Ca 0.19 -0.01 -0.12 0.00 -0.00 0.00 0.00 57.85 57.92 2o5j n ARG 6 Cb 0.47 -0.75 -0.12 0.00 0.00 0.00 0.00 32.46 32.07 2o5j n ARG 6 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2o5j s LYS 7 N -1.51 0.32 0.16 -0.14 3.01 -1.26 -2.92 119.74 117.39 2o5j s LYS 7 Ca 0.01 0.62 0.06 0.00 -1.01 0.00 0.00 55.97 55.65 2o5j s LYS 7 Cb 0.03 -0.02 -0.04 0.00 -1.01 0.00 0.00 37.83 36.79 2o5j s LYS 7 CO 0.15 -0.14 0.05 0.14 0.51 0.00 0.00 175.35 176.06 2o5j s VAL 8 N 1.09 4.07 -0.15 3.17 -7.23 -1.12 -4.80 120.40 115.43 2o5j s VAL 8 Ca -0.07 -1.21 -0.08 0.00 -1.81 0.00 0.00 61.98 58.81 2o5j s VAL 8 Cb -0.08 -3.04 0.06 0.00 0.56 0.00 0.00 36.38 33.88 2o5j s VAL 8 CO -0.08 -0.07 0.36 -0.60 -0.31 0.00 0.00 175.10 174.40 2o5j s ARG 9 N -2.89 0.32 -0.19 4.82 3.52 -1.21 0.73 118.95 124.05 2o5j s ARG 9 Ca 0.29 0.75 -0.13 0.00 -0.13 0.00 0.00 55.73 56.50 2o5j s ARG 9 Cb -0.10 -0.02 -0.05 0.00 -1.56 0.00 0.00 34.95 33.23 2o5j s ARG 9 CO 0.20 -0.18 0.26 0.42 -0.81 0.00 0.00 175.30 175.20 2o5j s ILE 10 N 1.55 5.31 0.01 4.11 1.01 -1.18 -4.86 121.20 127.16 2o5j s ILE 10 Ca -0.08 0.45 -0.01 0.00 0.00 0.00 0.00 60.65 61.01 2o5j s ILE 10 Cb -0.09 -3.60 -0.01 0.00 0.01 0.00 0.00 42.46 38.77 2o5j s ILE 10 CO -0.11 0.36 0.00 0.00 0.00 0.00 0.00 174.94 175.19 2o5j s ALA 11 N 0.71 0.03 1.03 9.38 0.00 -1.25 -2.93 121.76 128.73 2o5j s ALA 11 Ca 0.14 -0.37 -0.12 0.00 0.00 0.00 0.00 51.96 51.61 2o5j s ALA 11 Cb -0.13 0.10 0.21 0.00 0.00 0.00 0.00 23.12 23.30 2o5j s ALA 11 CO 0.04 -0.13 1.08 -0.51 0.00 0.00 0.00 175.76 176.24 2o5j s LEU 12 N -1.07 1.73 -0.13 0.00 1.43 -1.26 -4.92 118.68 114.46 2o5j s LEU 12 Ca -0.12 1.70 -0.05 0.00 -1.03 0.00 0.00 54.13 54.63 2o5j s LEU 12 Cb -0.07 -3.86 -0.04 0.00 0.03 0.00 0.00 46.19 42.25 2o5j s LEU 12 CO -0.00 -3.54 0.05 0.00 0.23 0.00 0.00 176.35 173.09 2o5j s ALA 13 N -2.63 3.46 0.03 4.21 0.00 -1.26 -5.08 121.76 120.49 2o5j s ALA 13 Ca 0.67 -0.74 -0.21 0.00 0.00 0.00 0.00 51.96 51.67 2o5j s ALA 13 Cb -0.23 -1.77 -0.06 0.00 0.00 0.00 0.00 23.12 21.07 2o5j s ALA 13 CO 0.61 0.42 0.64 -1.12 0.00 0.00 0.00 175.76 176.31 2o5j s SER 14 N -0.38 7.07 0.33 0.00 0.01 -1.26 -4.79 113.70 114.68 2o5j s SER 14 Ca 0.09 1.27 0.12 0.00 1.31 0.00 0.00 55.95 58.74 2o5j s SER 14 Cb -0.12 -2.39 1.03 0.00 0.21 0.00 0.00 66.02 64.74 2o5j s SER 14 CO 0.02 0.13 1.64 -0.65 0.41 0.00 0.00 173.24 174.79 2o5j h PRO 15 N 5.34 0.23 -0.39 12.44 0.11 -1.96 1.57 132.00 149.34 2o5j h PRO 15 Ca -0.46 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 2o5j h PRO 15 Cb 1.20 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2o5j h PRO 15 CO 0.68 0.15 -0.13 0.93 -0.21 0.00 0.00 178.00 179.42 2o5j h GLU 16 N 0.23 0.71 -0.10 1.05 3.07 -2.00 -1.19 114.58 116.36 2o5j h GLU 16 Ca 0.71 -0.24 -0.04 0.00 -0.50 0.00 0.00 59.36 59.29 2o5j h GLU 16 Cb 1.61 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 29.46 2o5j h GLU 16 CO -0.66 0.81 -0.10 0.87 -1.40 0.00 0.00 179.01 178.53 2o5j h LYS 17 N 0.64 0.15 -0.01 2.33 1.57 0.18 0.35 116.57 121.78 2o5j h LYS 17 Ca 0.11 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.89 2o5j h LYS 17 Cb 0.59 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.83 2o5j h LYS 17 CO 0.04 0.26 -0.33 0.82 -0.57 0.00 0.00 179.45 179.67 2o5j h ILE 18 N 0.14 0.29 -0.33 1.86 1.08 0.15 0.07 117.51 120.77 2o5j h ILE 18 Ca 0.03 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.44 2o5j h ILE 18 Cb 0.28 0.29 -0.02 0.00 -3.07 0.00 0.00 36.82 34.30 2o5j h ILE 18 CO 0.02 0.00 -0.05 0.03 -0.69 0.00 0.00 178.15 177.46 2o5j h ARG 19 N -0.48 0.53 0.03 2.37 2.47 -1.18 -1.92 114.38 116.21 2o5j h ARG 19 Ca 0.06 -0.13 0.03 0.00 -1.26 0.00 0.00 59.98 58.68 2o5j h ARG 19 Cb 0.57 -0.07 -0.04 0.00 -1.65 0.00 0.00 29.97 28.78 2o5j h ARG 19 CO -0.27 0.59 -0.21 1.03 0.56 0.00 0.00 179.97 181.67 2o5j h SER 20 N 0.50 -0.61 1.08 7.04 0.87 0.11 -0.83 113.55 121.71 2o5j h SER 20 Ca 0.10 0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.73 2o5j h SER 20 Cb 0.39 0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.60 2o5j h SER 20 CO 0.02 -0.28 -0.08 -0.50 -0.53 0.00 0.00 176.83 175.46 2o5j h TRP 21 N -0.35 0.00 -4.35 2.24 6.55 -0.91 -3.46 115.95 115.67 2o5j h TRP 21 Ca 0.05 0.00 -0.51 0.00 0.95 0.00 0.00 58.89 59.39 2o5j h TRP 21 Cb 0.41 0.00 0.09 0.00 -0.86 0.00 0.00 29.16 28.80 2o5j h TRP 21 CO -0.24 0.08 0.38 -1.54 -1.05 0.00 0.00 178.44 176.07 2o5j s SER 22 N -5.91 5.49 -0.17 -3.49 1.04 -0.32 -4.19 113.70 106.16 2o5j s SER 22 Ca 0.01 1.45 -0.04 0.00 0.48 0.00 0.00 55.95 57.85 2o5j s SER 22 Cb 0.09 -2.34 0.08 0.00 0.10 0.00 0.00 66.02 63.95 2o5j s SER 22 CO 0.59 -1.35 0.27 -0.31 0.98 0.00 0.00 173.24 173.42 2o5j s TYR 23 N -3.14 -0.44 0.60 5.02 1.51 0.65 -4.94 117.35 116.61 2o5j s TYR 23 Ca 0.58 0.72 0.00 0.00 -1.01 0.00 0.00 57.07 57.36 2o5j s TYR 23 Cb -0.13 -0.13 0.00 0.00 -0.11 0.00 0.00 41.96 41.60 2o5j s TYR 23 CO 0.54 -0.49 0.00 0.41 -1.11 0.00 0.00 175.55 174.90 2o5j n GLY 24 N 5.34 -3.22 2.97 0.71 0.00 -1.26 -3.86 105.19 105.88 2o5j n GLY 24 Ca -0.06 -1.05 -0.29 0.00 0.00 0.00 0.00 46.02 44.63 2o5j n GLY 24 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o5j s GLU 25 N -4.06 1.98 -0.25 1.61 2.12 -1.23 0.34 118.70 119.22 2o5j s GLU 25 Ca 0.00 -0.44 -0.29 0.00 0.36 0.00 0.00 54.97 54.61 2o5j s GLU 25 Cb 0.00 -1.89 -0.02 0.00 0.26 0.00 0.00 34.13 32.48 2o5j s GLU 25 CO 0.00 -0.24 1.60 0.08 -0.54 0.00 0.00 175.26 176.15 2o5j s VAL 26 N 1.56 3.72 -0.49 3.70 1.01 -1.20 -4.83 120.40 123.86 2o5j s VAL 26 Ca 0.05 0.80 0.05 0.00 0.00 0.00 0.00 61.98 62.88 2o5j s VAL 26 Cb -0.13 -3.76 0.13 0.00 0.00 0.00 0.00 36.38 32.62 2o5j s VAL 26 CO -0.09 -0.34 1.05 -1.84 0.00 0.00 0.00 175.10 173.87 2o5j n GLU 27 N 7.72 2.40 -3.73 2.72 0.28 -1.26 -4.85 120.64 123.92 2o5j n GLU 27 Ca 0.19 -1.61 -0.13 0.00 -0.16 0.00 0.00 57.16 55.44 2o5j n GLU 27 Cb 0.46 -1.13 -0.10 0.00 1.43 0.00 0.00 31.44 32.10 2o5j n GLU 27 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 2o5j s LYS 28 N -0.91 0.51 -1.00 3.44 2.47 -1.26 -4.91 119.74 118.08 2o5j s LYS 28 Ca 0.10 0.45 -0.07 0.00 -1.56 0.00 0.00 55.97 54.90 2o5j s LYS 28 Cb 0.06 0.25 -0.09 0.00 -1.46 0.00 0.00 37.83 36.59 2o5j s LYS 28 CO 0.08 -0.08 2.48 -0.35 0.16 0.00 0.00 175.35 177.64 2o5j n PRO 29 N 2.59 2.50 -3.98 4.03 -0.04 -1.26 -3.82 135.00 135.02 2o5j n PRO 29 Ca -0.14 -1.58 -0.31 0.00 -0.04 0.00 0.00 63.50 61.43 2o5j n PRO 29 Cb 0.57 -2.47 -0.15 0.00 -0.04 0.00 0.00 33.50 31.41 2o5j n PRO 29 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2o5j s GLU 30 N 2.74 1.40 0.00 0.54 0.41 -1.26 -5.00 118.70 117.53 2o5j s GLU 30 Ca 0.50 -1.80 0.00 0.00 -0.41 0.00 0.00 54.97 53.26 2o5j s GLU 30 Cb 0.15 -3.07 0.00 0.00 -1.78 0.00 0.00 34.13 29.43 2o5j s GLU 30 CO -0.04 -0.95 0.34 0.25 -0.49 0.00 0.00 175.26 174.37 2o5j n THR 31 N 4.29 0.00 -3.73 3.63 -2.24 -1.26 -3.38 114.28 111.60 2o5j n THR 31 Ca 0.03 0.68 -0.12 0.00 -2.27 0.00 0.00 64.05 62.37 2o5j n THR 31 Cb 0.42 -1.36 -0.11 0.00 -2.10 0.00 0.00 70.33 67.18 2o5j n THR 31 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2o5j s ILE 32 N -0.69 -0.01 -0.51 2.28 1.01 -1.26 -3.10 121.20 118.91 2o5j s ILE 32 Ca 0.00 0.04 -0.20 0.00 0.00 0.00 0.00 60.65 60.49 2o5j s ILE 32 Cb 0.00 -0.54 0.06 0.00 0.01 0.00 0.00 42.46 41.98 2o5j s ILE 32 CO 0.00 0.01 0.65 0.21 0.00 0.00 0.00 174.94 175.81 2o5j s ASN 33 N 0.60 6.24 0.00 3.58 3.84 -1.21 -4.89 114.94 123.10 2o5j s ASN 33 Ca -0.03 -0.85 0.00 0.00 0.21 0.00 0.00 52.86 52.19 2o5j s ASN 33 Cb -0.05 -2.30 0.00 0.00 -0.55 0.00 0.00 41.25 38.35 2o5j s ASN 33 CO -0.04 -0.91 0.00 0.00 -2.79 0.00 0.00 177.10 173.36 2o5j n TYR 34 N 6.27 0.00 -0.16 0.43 -0.00 -1.26 -1.18 117.16 121.25 2o5j n TYR 34 Ca -0.06 0.00 -0.04 0.00 -0.00 0.00 0.00 57.90 57.80 2o5j n TYR 34 Cb 0.46 -0.04 -0.04 0.00 -0.00 0.00 0.00 39.34 39.71 2o5j n TYR 34 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2o5j n ARG 35 N -1.83 -0.17 -3.99 -3.48 1.74 -1.26 -2.99 116.66 104.68 2o5j n ARG 35 Ca 0.00 0.59 -0.34 0.00 -0.77 0.00 0.00 57.85 57.33 2o5j n ARG 35 Cb 0.00 -0.87 -0.15 0.00 -1.02 0.00 0.00 32.46 30.42 2o5j n ARG 35 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2o5j s THR 36 N -5.20 2.67 -0.44 0.55 -4.23 -0.33 -4.98 115.64 103.68 2o5j s THR 36 Ca -0.05 -1.18 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 2o5j s THR 36 Cb 0.04 -2.40 0.00 0.00 1.34 0.00 0.00 72.50 71.49 2o5j s THR 36 CO 0.24 0.15 0.27 0.18 -0.54 0.00 0.00 174.62 174.93 2o5j n LEU 37 N 4.61 0.74 -4.91 4.79 4.77 -1.16 -3.88 117.00 121.96 2o5j n LEU 37 Ca -0.16 -0.37 -0.27 0.00 -0.03 0.00 0.00 56.01 55.18 2o5j n LEU 37 Cb 0.46 -0.17 0.01 0.00 -2.33 0.00 0.00 43.42 41.39 2o5j n LEU 37 CO 0.26 0.14 0.48 -0.75 -1.33 0.00 0.00 177.39 176.19 2o5j s LYS 38 N -0.07 3.34 0.31 3.23 2.20 -1.26 -4.88 119.74 122.61 2o5j s LYS 38 Ca 0.00 0.16 -0.29 0.00 -0.36 0.00 0.00 55.97 55.47 2o5j s LYS 38 Cb 0.00 -2.33 -0.12 0.00 -1.51 0.00 0.00 37.83 33.87 2o5j s LYS 38 CO 0.00 -0.38 1.49 -2.30 -0.36 0.00 0.00 175.35 173.80 2o5j n PRO 39 N -2.39 2.50 0.00 4.03 -0.02 -1.26 -3.32 135.00 134.54 2o5j n PRO 39 Ca 0.02 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2o5j n PRO 39 Cb 0.56 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 2o5j n PRO 39 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2o5j n GLU 40 N 1.51 0.00 0.00 -0.52 4.07 -1.18 -4.82 120.64 119.70 2o5j n GLU 40 Ca 0.07 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.17 2o5j n GLU 40 Cb 0.36 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.74 2o5j n GLU 40 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 2o5j n ARG 41 N 0.00 0.31 -0.32 5.31 -4.01 -1.26 -4.88 116.66 111.82 2o5j n ARG 41 Ca 0.00 0.00 0.30 0.00 -1.04 0.00 0.00 57.85 57.11 2o5j n ARG 41 Cb 0.00 0.00 0.65 0.00 -3.04 0.00 0.00 32.46 30.07 2o5j n ARG 41 CO 0.00 0.00 0.00 0.22 -3.04 0.00 0.00 177.63 174.81 2o5j h ASP 42 N 0.00 0.19 0.00 2.89 3.58 -1.91 -3.38 116.42 117.78 2o5j h ASP 42 Ca 0.00 0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.49 2o5j h ASP 42 Cb 0.00 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2o5j h ASP 42 CO 0.00 0.03 0.00 0.61 -2.88 0.00 0.00 179.24 177.00 2o5j n GLY 43 N -1.64 0.00 0.00 -0.78 0.00 -1.25 -4.00 105.19 97.51 2o5j n GLY 43 Ca 0.25 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.28 2o5j n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2o5j n LEU 44 N 0.00 0.00 0.00 0.99 4.77 -1.22 -2.39 117.00 119.15 2o5j n LEU 44 Ca 0.00 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 2o5j n LEU 44 Cb 0.00 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.65 2o5j n LEU 44 CO 0.00 -0.41 0.08 0.33 -1.33 0.00 0.00 177.39 176.06 2o5j n PHE 45 N -1.44 0.00 -1.32 -1.77 -0.00 -1.26 -4.66 117.46 107.01 2o5j n PHE 45 Ca 0.01 0.00 -0.45 0.00 -0.00 0.00 0.00 57.45 57.00 2o5j n PHE 45 Cb 0.02 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 39.47 2o5j n PHE 45 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 2o5j n ASP 46 N -0.65 -1.25 0.23 -2.13 2.03 -1.01 -4.82 116.55 108.95 2o5j n ASP 46 Ca 0.00 1.06 0.13 0.00 0.52 0.00 0.00 54.79 56.49 2o5j n ASP 46 Cb 0.00 -0.90 0.34 0.00 -0.72 0.00 0.00 41.12 39.85 2o5j n ASP 46 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2o5j h GLU 47 N 0.92 0.00 0.48 -0.67 3.07 -1.91 -2.95 114.58 113.52 2o5j h GLU 47 Ca -0.27 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.57 2o5j h GLU 47 Cb 1.36 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.28 2o5j h GLU 47 CO 0.54 0.06 -0.23 -0.09 -1.40 0.00 0.00 179.01 177.88 2o5j h ARG 48 N 0.00 -0.62 -0.11 2.33 2.43 -1.81 0.98 114.38 117.58 2o5j h ARG 48 Ca -0.00 0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.24 2o5j h ARG 48 Cb 0.86 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2o5j h ARG 48 CO 0.01 -0.41 0.14 0.82 -1.51 0.00 0.00 179.97 179.01 2o5j h ILE 49 N -0.97 0.45 0.00 1.20 2.04 -1.80 -3.37 117.51 115.06 2o5j h ILE 49 Ca -0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.79 2o5j h ILE 49 Cb 0.49 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 2o5j h ILE 49 CO 0.11 0.00 -0.79 0.49 0.00 0.00 0.00 178.15 177.96 2o5j n PHE 50 N -3.75 -0.01 0.00 1.37 3.01 -1.11 -4.19 117.46 112.78 2o5j n PHE 50 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2o5j n PHE 50 Cb 0.24 0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.81 2o5j n PHE 50 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2o5j n GLY 51 N 2.72 1.58 3.61 1.37 0.00 0.34 -4.31 105.19 110.50 2o5j n GLY 51 Ca 0.00 -1.40 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 2o5j n GLY 51 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2o5j s PRO 52 N -1.88 3.38 0.55 1.61 0.02 -1.26 -4.19 135.00 133.22 2o5j s PRO 52 Ca 0.00 1.87 0.26 0.00 0.02 0.00 0.00 61.00 63.16 2o5j s PRO 52 Cb 0.00 -4.26 1.44 0.00 0.02 0.00 0.00 34.50 31.70 2o5j s PRO 52 CO 0.00 -1.81 1.99 0.97 -0.33 0.00 0.00 177.00 177.81 2o5j h ILE 53 N 6.77 0.65 -0.93 2.83 2.10 -1.92 -3.38 117.51 123.63 2o5j h ILE 53 Ca -0.39 0.00 -0.57 0.00 1.08 0.00 0.00 64.86 64.98 2o5j h ILE 53 Cb 1.21 0.72 -0.06 0.00 -1.09 0.00 0.00 36.82 37.60 2o5j h ILE 53 CO 0.98 0.00 -0.38 -0.75 -1.08 0.00 0.00 178.15 176.93 2o5j s LYS 54 N -4.92 2.28 0.00 2.19 2.47 -1.26 -4.84 119.74 115.66 2o5j s LYS 54 Ca -0.05 -1.94 0.00 0.00 -1.56 0.00 0.00 55.97 52.42 2o5j s LYS 54 Cb 0.19 -2.06 0.00 0.00 -1.46 0.00 0.00 37.83 34.49 2o5j s LYS 54 CO 0.69 -0.41 0.00 -0.25 0.16 0.00 0.00 175.35 175.53 2o5j n ASP 55 N -1.56 0.00 -0.01 1.43 8.00 -1.26 -3.69 116.55 119.46 2o5j n ASP 55 Ca -0.02 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.57 2o5j n ASP 55 Cb 0.64 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.61 2o5j n ASP 55 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2o5j n TYR 56 N 0.00 0.00 -1.62 1.24 9.36 -1.26 -3.64 117.16 121.23 2o5j n TYR 56 Ca 0.00 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 60.89 2o5j n TYR 56 Cb 0.00 -0.27 0.06 0.00 -0.63 0.00 0.00 39.34 38.50 2o5j n TYR 56 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 2o5j s GLU 57 N -3.07 2.63 0.00 2.98 -6.30 -1.24 -4.60 118.70 109.11 2o5j s GLU 57 Ca -0.02 1.36 0.00 0.00 -2.50 0.00 0.00 54.97 53.81 2o5j s GLU 57 Cb 0.12 -1.93 0.00 0.00 0.00 0.00 0.00 34.13 32.32 2o5j s GLU 57 CO 0.76 -1.37 0.00 0.00 0.02 0.00 0.00 175.26 174.66 2o5j h ALA 59 N -1.05 -0.43 0.07 0.00 0.00 -1.94 -3.39 119.26 112.53 2o5j h ALA 59 Ca 0.00 -0.08 -0.26 0.00 0.00 0.00 0.00 54.91 54.57 2o5j h ALA 59 Cb 0.00 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2o5j h ALA 59 CO 0.00 -0.40 -1.28 0.00 0.00 0.00 0.00 179.25 177.57 2o5j n GLY 61 N 1.51 1.38 0.08 0.00 0.00 -1.26 -5.03 105.19 101.88 2o5j n GLY 61 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 2o5j n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o5j h LYS 62 N 0.22 0.16 -5.23 1.61 1.57 -1.94 -3.41 116.57 109.55 2o5j h LYS 62 Ca 0.00 -0.02 -0.66 0.00 -1.87 0.00 0.00 60.65 58.10 2o5j h LYS 62 Cb 0.00 -0.03 -0.30 0.00 0.08 0.00 0.00 32.23 31.98 2o5j h LYS 62 CO 0.00 0.18 -0.80 0.71 -0.57 0.00 0.00 179.45 178.97 2o5j s TYR 63 N -5.87 2.77 0.00 -1.35 1.51 -1.26 -5.04 117.35 108.11 2o5j s TYR 63 Ca -0.13 -0.94 0.00 0.00 -1.01 0.00 0.00 57.07 54.99 2o5j s TYR 63 Cb 0.07 -1.86 0.00 0.00 -0.11 0.00 0.00 41.96 40.05 2o5j s TYR 63 CO 0.68 -0.40 0.00 1.63 -1.11 0.00 0.00 175.55 176.35 2o5j n LYS 64 N 3.88 4.96 0.00 -0.62 5.02 -1.26 -3.36 118.16 126.78 2o5j n LYS 64 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 2o5j n LYS 64 Cb 0.52 -0.48 0.00 0.00 -0.02 0.00 0.00 35.03 35.05 2o5j n LYS 64 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2o5j n ARG 65 N -0.87 3.93 0.03 1.97 3.00 -1.26 -3.64 116.66 119.81 2o5j n ARG 65 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2o5j n ARG 65 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 32.37 2o5j n ARG 65 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2o5j n GLN 66 N 0.00 0.62 -0.30 -0.14 0.00 -1.26 -4.35 117.38 111.95 2o5j n GLN 66 Ca 0.00 0.22 0.14 0.00 -0.00 0.00 0.00 57.00 57.35 2o5j n GLN 66 Cb 0.00 -1.80 0.30 0.00 0.00 0.00 0.00 30.24 28.74 2o5j n GLN 66 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 2o5j h ARG 67 N 0.00 0.22 -1.26 3.69 9.65 -2.01 0.01 114.38 124.68 2o5j h ARG 67 Ca -0.17 -0.01 -0.64 0.00 -1.10 0.00 0.00 59.98 58.06 2o5j h ARG 67 Cb 1.60 -0.05 -0.36 0.00 -1.39 0.00 0.00 29.97 29.77 2o5j h ARG 67 CO 0.05 0.15 0.00 1.97 2.80 0.00 0.00 179.97 184.93 2o5j n PHE 68 N -5.20 3.09 -0.16 2.20 1.16 -1.26 -4.85 117.46 112.43 2o5j n PHE 68 Ca 0.22 -2.67 0.12 0.00 -1.87 0.00 0.00 57.45 53.25 2o5j n PHE 68 Cb 0.70 -0.72 0.44 0.00 -1.61 0.00 0.00 39.48 38.29 2o5j n PHE 68 CO 0.00 0.00 0.00 1.05 -1.87 0.00 0.00 176.76 175.94 2o5j h GLU 69 N 2.41 0.53 -0.65 3.97 4.11 -1.19 -2.96 114.58 120.80 2o5j h GLU 69 Ca 0.45 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.85 2o5j h GLU 69 Cb 0.89 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.02 2o5j h GLU 69 CO 1.13 0.35 0.00 0.41 0.07 0.00 0.00 179.01 180.97 2o5j n GLY 70 N -1.49 2.29 3.82 1.06 0.00 -1.26 -3.68 105.19 105.94 2o5j n GLY 70 Ca 0.13 -0.79 -0.27 0.00 0.00 0.00 0.00 46.02 45.09 2o5j n GLY 70 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2o5j s LYS 71 N -1.14 3.00 -0.01 1.61 2.20 -1.12 -4.98 119.74 119.31 2o5j s LYS 71 Ca 0.47 -0.78 -0.04 0.00 -0.36 0.00 0.00 55.97 55.25 2o5j s LYS 71 Cb 0.25 -2.72 -0.04 0.00 -1.51 0.00 0.00 37.83 33.80 2o5j s LYS 71 CO 0.33 0.51 0.20 0.54 -0.36 0.00 0.00 175.35 176.57 2o5j s VAL 72 N -1.69 5.40 0.20 4.02 0.11 -1.26 -4.53 120.40 122.65 2o5j s VAL 72 Ca 0.31 -0.06 -0.31 0.00 -2.93 0.00 0.00 61.98 58.99 2o5j s VAL 72 Cb -0.11 -3.54 -0.09 0.00 -1.53 0.00 0.00 36.38 31.11 2o5j s VAL 72 CO 0.24 0.34 1.43 0.00 -3.33 0.00 0.00 175.10 173.78 2o5j h GLU 74 N 5.79 0.20 0.04 0.00 3.07 -1.98 -3.23 114.58 118.46 2o5j h GLU 74 Ca -0.44 -0.01 -0.35 0.00 -0.50 0.00 0.00 59.36 58.06 2o5j h GLU 74 Cb 1.21 -0.04 -0.05 0.00 -0.84 0.00 0.00 28.75 29.03 2o5j h GLU 74 CO 0.82 0.13 -2.07 2.89 -1.40 0.00 0.00 179.01 179.38 2o5j n ARG 75 N -5.15 0.69 -5.07 2.33 1.85 -1.26 -4.92 116.66 105.13 2o5j n ARG 75 Ca 0.06 0.20 -0.28 0.00 -1.00 0.00 0.00 57.85 56.83 2o5j n ARG 75 Cb 0.26 -1.67 -0.16 0.00 -1.05 0.00 0.00 32.46 29.85 2o5j n ARG 75 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2o5j s GLY 77 N -0.36 1.23 -0.29 0.00 0.00 -1.26 -3.45 107.32 103.19 2o5j s GLY 77 Ca 0.04 -1.15 0.01 0.00 0.00 0.00 0.00 44.72 43.61 2o5j s GLY 77 CO 0.00 2.31 0.34 0.14 0.00 0.00 0.00 173.10 175.89 2o5j s VAL 78 N 4.59 -0.49 0.16 1.40 1.01 -1.26 -4.34 120.40 121.48 2o5j s VAL 78 Ca 0.35 -0.42 -0.22 0.00 0.00 0.00 0.00 61.98 61.69 2o5j s VAL 78 Cb -0.10 -0.99 -0.08 0.00 0.00 0.00 0.00 36.38 35.21 2o5j s VAL 78 CO 0.20 -0.40 0.70 -0.70 0.00 0.00 0.00 175.10 174.90 2o5j s GLU 79 N 2.42 4.35 -0.03 2.72 2.12 -1.26 -4.06 118.70 124.96 2o5j s GLU 79 Ca 0.09 0.94 -0.01 0.00 0.36 0.00 0.00 54.97 56.36 2o5j s GLU 79 Cb -0.13 -3.11 0.03 0.00 0.26 0.00 0.00 34.13 31.18 2o5j s GLU 79 CO -0.32 0.52 0.03 0.08 -0.54 0.00 0.00 175.26 175.03 2o5j s VAL 80 N -1.29 0.00 0.00 3.70 1.01 -1.24 -4.45 120.40 118.14 2o5j s VAL 80 Ca 0.37 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.60 2o5j s VAL 80 Cb -0.20 -0.17 0.00 0.00 0.00 0.00 0.00 36.38 36.01 2o5j s VAL 80 CO 0.22 0.14 0.00 0.41 0.00 0.00 0.00 175.10 175.88 2o5j n THR 81 N 4.59 0.00 -0.28 3.92 -1.04 -1.26 -4.78 114.28 115.43 2o5j n THR 81 Ca -0.18 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.76 2o5j n THR 81 Cb 0.50 -0.33 0.06 0.00 -1.82 0.00 0.00 70.33 68.74 2o5j n THR 81 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2o5j n LYS 82 N -0.18 -2.16 0.00 -2.82 4.81 -1.25 -4.37 118.16 112.19 2o5j n LYS 82 Ca 0.00 -0.34 0.04 0.00 -0.87 0.00 0.00 58.31 57.14 2o5j n LYS 82 Cb 0.00 -0.38 0.19 0.00 0.02 0.00 0.00 35.03 34.86 2o5j n LYS 82 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2o5j n SER 83 N -3.53 0.00 -0.07 3.14 3.41 -1.24 -2.49 113.62 112.85 2o5j n SER 83 Ca 0.03 0.15 -0.10 0.00 -0.26 0.00 0.00 58.87 58.69 2o5j n SER 83 Cb 0.13 -0.26 -0.03 0.00 -0.26 0.00 0.00 64.21 63.78 2o5j n SER 83 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 2o5j h ILE 84 N 0.00 1.13 -0.25 -1.33 3.07 -1.88 0.12 117.51 118.38 2o5j h ILE 84 Ca 0.00 -0.36 0.07 0.00 1.55 0.00 0.00 64.86 66.12 2o5j h ILE 84 Cb 0.06 0.93 -0.01 0.00 -0.27 0.00 0.00 36.82 37.54 2o5j h ILE 84 CO 0.00 0.13 0.28 -0.37 -1.05 0.00 0.00 178.15 177.14 2o5j h VAL 85 N 0.26 0.43 0.00 0.16 -1.51 -1.77 0.18 116.25 113.99 2o5j h VAL 85 Ca 0.08 0.00 -0.11 0.00 -1.23 0.00 0.00 66.70 65.45 2o5j h VAL 85 Cb 0.09 0.78 -0.02 0.00 -2.13 0.00 0.00 31.29 30.01 2o5j h VAL 85 CO -0.01 0.00 -0.51 -0.09 -1.23 0.00 0.00 177.57 175.73 2o5j h ARG 86 N 0.00 0.00 0.00 5.19 2.43 -0.90 -2.65 114.38 118.45 2o5j h ARG 86 Ca 0.12 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2o5j h ARG 86 Cb 0.68 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2o5j h ARG 86 CO -0.00 0.51 -0.86 -2.13 -1.51 0.00 0.00 179.97 175.98 2o5j n ARG 87 N -3.92 0.17 -0.07 0.20 0.63 0.57 -4.23 116.66 110.00 2o5j n ARG 87 Ca -0.01 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.78 2o5j n ARG 87 Cb 0.53 -1.56 -0.14 0.00 0.45 0.00 0.00 32.46 31.73 2o5j n ARG 87 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2o5j n TYR 88 N -1.78 0.43 -1.96 -0.14 0.53 -0.89 -4.69 117.16 108.66 2o5j n TYR 88 Ca 0.03 0.12 -0.37 0.00 -1.02 0.00 0.00 57.90 56.66 2o5j n TYR 88 Cb 0.39 -1.07 0.04 0.00 -1.03 0.00 0.00 39.34 37.67 2o5j n TYR 88 CO 0.00 0.00 0.00 1.03 -1.02 0.00 0.00 176.86 176.87 2o5j s ARG 89 N -2.53 3.01 0.11 -0.72 3.00 -1.01 -4.95 118.95 115.87 2o5j s ARG 89 Ca -0.19 1.93 0.10 0.00 0.00 0.00 0.00 55.73 57.57 2o5j s ARG 89 Cb 0.07 -2.02 -0.04 0.00 0.00 0.00 0.00 34.95 32.97 2o5j s ARG 89 CO 0.75 -1.20 -0.26 -1.64 0.00 0.00 0.00 175.30 172.95 2o5j s MET 90 N -3.20 1.54 0.53 3.54 -1.94 -1.26 -4.28 119.30 114.23 2o5j s MET 90 Ca 0.76 -1.27 0.04 0.00 -1.71 0.00 0.00 55.69 53.51 2o5j s MET 90 Cb -0.33 -1.95 0.02 0.00 2.01 0.00 0.00 34.83 34.58 2o5j s MET 90 CO 0.37 0.47 0.28 0.20 -0.01 0.00 0.00 175.02 176.33 2o5j s GLY 91 N -1.88 2.56 0.03 -0.03 0.00 -1.23 -0.25 107.32 106.52 2o5j s GLY 91 Ca 0.14 -1.01 -0.02 0.00 0.00 0.00 0.00 44.72 43.83 2o5j s GLY 91 CO 0.06 -2.01 0.01 -2.38 0.00 0.00 0.00 173.10 168.77 2o5j s HIS 92 N -2.80 0.32 -0.17 1.90 -3.43 0.15 -2.77 115.29 108.49 2o5j s HIS 92 Ca 0.26 -0.68 0.01 0.00 -0.80 0.00 0.00 55.06 53.85 2o5j s HIS 92 Cb -0.01 -0.24 0.02 0.00 -1.43 0.00 0.00 32.58 30.92 2o5j s HIS 92 CO 0.16 -0.30 -0.20 0.42 -2.00 0.00 0.00 174.74 172.82 2o5j s ILE 93 N -2.57 2.11 -0.60 -5.38 1.01 -0.97 -3.26 121.20 111.54 2o5j s ILE 93 Ca -0.05 -0.93 -0.23 0.00 0.00 0.00 0.00 60.65 59.43 2o5j s ILE 93 Cb -0.02 -1.88 0.05 0.00 0.01 0.00 0.00 42.46 40.63 2o5j s ILE 93 CO -0.05 0.54 0.95 -0.70 0.00 0.00 0.00 174.94 175.68 2o5j s GLU 94 N 1.20 3.22 0.46 2.79 2.56 -1.26 -1.75 118.70 125.91 2o5j s GLU 94 Ca 0.03 -0.54 -0.24 0.00 0.00 0.00 0.00 54.97 54.22 2o5j s GLU 94 Cb -0.14 -4.14 -0.07 0.00 2.00 0.00 0.00 34.13 31.79 2o5j s GLU 94 CO -0.10 -1.65 1.26 -1.17 -0.56 0.00 0.00 175.26 173.04 2o5j s LEU 95 N 4.03 4.05 0.00 2.70 0.20 -0.87 -5.00 118.68 123.79 2o5j s LEU 95 Ca 0.26 2.55 0.00 0.00 0.69 0.00 0.00 54.13 57.63 2o5j s LEU 95 Cb -0.14 -4.12 0.00 0.00 -0.43 0.00 0.00 46.19 41.49 2o5j s LEU 95 CO 0.15 -1.05 0.23 0.00 -0.29 0.00 0.00 176.35 175.39 2o5j n ALA 96 N -0.39 0.00 -2.77 5.97 0.00 -1.26 -4.73 120.51 117.33 2o5j n ALA 96 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.15 2o5j n ALA 96 Cb 0.46 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.81 2o5j n ALA 96 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2o5j s THR 97 N -0.47 5.04 0.67 0.00 2.01 -1.26 -5.06 115.64 116.57 2o5j s THR 97 Ca 0.00 0.07 -0.18 0.00 0.31 0.00 0.00 61.69 61.89 2o5j s THR 97 Cb 0.00 -3.32 -0.14 0.00 0.01 0.00 0.00 72.50 69.05 2o5j s THR 97 CO 0.00 0.39 -0.24 -2.65 -0.69 0.00 0.00 174.62 171.43 2o5j n PRO 98 N 4.02 0.04 -2.12 4.92 -0.01 -1.26 -4.94 135.00 135.65 2o5j n PRO 98 Ca -0.16 0.02 -0.01 0.00 -0.01 0.00 0.00 63.50 63.34 2o5j n PRO 98 Cb 0.52 -1.10 -0.00 0.00 -0.01 0.00 0.00 33.50 32.90 2o5j n PRO 98 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 2o5j n ALA 99 N -1.90 0.04 -2.49 3.55 0.00 0.86 -4.46 120.51 116.11 2o5j n ALA 99 Ca 0.05 -0.10 -0.09 0.00 0.00 0.00 0.00 53.44 53.30 2o5j n ALA 99 Cb 0.50 0.08 -0.08 0.00 0.00 0.00 0.00 19.45 19.95 2o5j n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2o5j s ALA 100 N -2.07 -0.09 0.06 0.00 0.00 -1.26 0.37 121.76 118.78 2o5j s ALA 100 Ca 0.02 -0.73 -0.30 0.00 0.00 0.00 0.00 51.96 50.94 2o5j s ALA 100 Cb 0.00 0.49 -0.09 0.00 0.00 0.00 0.00 23.12 23.52 2o5j s ALA 100 CO 0.01 -0.50 1.93 -1.58 0.00 0.00 0.00 175.76 175.62 2o5j s HIS 101 N -3.88 1.55 -0.05 0.00 2.46 -1.16 -4.76 115.29 109.45 2o5j s HIS 101 Ca 0.06 -0.33 0.31 0.00 0.47 0.00 0.00 55.06 55.57 2o5j s HIS 101 Cb 0.05 -4.23 1.13 0.00 -0.13 0.00 0.00 32.58 29.41 2o5j s HIS 101 CO -0.10 -5.37 1.89 0.97 -2.47 0.00 0.00 174.74 169.66 2o5j h ILE 102 N 5.34 0.00 -0.28 0.89 6.09 -1.92 -2.76 117.51 124.87 2o5j h ILE 102 Ca -0.48 -0.59 -0.00 0.00 -1.37 0.00 0.00 64.86 62.41 2o5j h ILE 102 Cb 1.23 1.57 -0.01 0.00 0.47 0.00 0.00 36.82 40.08 2o5j h ILE 102 CO 0.94 0.00 0.16 -0.50 -3.07 0.00 0.00 178.15 175.69 2o5j h TRP 103 N 0.00 0.35 0.00 2.19 4.06 -1.97 -0.55 115.95 120.03 2o5j h TRP 103 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2o5j h TRP 103 Cb 0.60 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 28.65 2o5j h TRP 103 CO 0.00 0.24 -1.13 1.19 -3.56 0.00 0.00 178.44 175.17 2o5j n PHE 104 N -4.48 0.00 -0.09 0.49 3.72 -1.07 -3.89 117.46 112.14 2o5j n PHE 104 Ca 0.01 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.25 2o5j n PHE 104 Cb 0.08 -0.10 -0.13 0.00 -0.94 0.00 0.00 39.48 38.39 2o5j n PHE 104 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2o5j n VAL 105 N -1.62 1.52 -0.03 -4.37 0.31 -0.96 -2.70 118.33 110.49 2o5j n VAL 105 Ca 0.02 -0.67 0.07 0.00 -0.01 0.00 0.00 64.34 63.75 2o5j n VAL 105 Cb 0.35 -1.21 0.16 0.00 -0.91 0.00 0.00 33.84 32.23 2o5j n VAL 105 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2o5j n LYS 106 N -3.15 2.38 -1.91 5.55 4.76 -0.26 -4.67 118.16 120.87 2o5j n LYS 106 Ca -0.39 -1.98 -0.37 0.00 -2.87 0.00 0.00 58.31 52.71 2o5j n LYS 106 Cb 1.04 -1.32 0.04 0.00 -1.84 0.00 0.00 35.03 32.96 2o5j n LYS 106 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2o5j s ASP 107 N -1.04 5.11 0.06 4.39 2.15 -1.25 -4.90 116.67 121.19 2o5j s ASP 107 Ca 0.26 2.53 -0.12 0.00 0.43 0.00 0.00 52.55 55.65 2o5j s ASP 107 Cb 0.14 -2.61 -0.03 0.00 -0.30 0.00 0.00 42.92 40.12 2o5j s ASP 107 CO 0.19 -1.66 1.06 1.33 -0.17 0.00 0.00 175.17 175.92 2o5j n VAL 108 N -1.47 -0.27 -2.77 1.11 0.24 -1.26 -2.94 118.33 110.96 2o5j n VAL 108 Ca 0.13 1.63 -0.43 0.00 -2.04 0.00 0.00 64.34 63.64 2o5j n VAL 108 Cb 0.48 -2.09 -0.04 0.00 -1.47 0.00 0.00 33.84 30.73 2o5j n VAL 108 CO 0.00 0.00 0.00 -2.84 -2.14 0.00 0.00 176.83 171.85 2o5j s PRO 109 N -4.12 3.36 -0.68 7.34 0.02 -1.26 -4.92 135.00 134.74 2o5j s PRO 109 Ca -0.05 -0.17 -0.27 0.00 0.02 0.00 0.00 61.00 60.53 2o5j s PRO 109 Cb 0.04 -4.06 -0.13 0.00 0.02 0.00 0.00 34.50 30.38 2o5j s PRO 109 CO 0.24 -1.57 2.49 0.43 -0.33 0.00 0.00 177.00 178.27 2o5j n SER 110 N 7.76 1.56 -0.07 2.53 7.64 -1.15 -4.71 113.62 127.18 2o5j n SER 110 Ca 0.03 -0.38 0.25 0.00 1.01 0.00 0.00 58.87 59.78 2o5j n SER 110 Cb 0.48 -1.36 0.71 0.00 -1.01 0.00 0.00 64.21 63.02 2o5j n SER 110 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2o5j h LYS 111 N 16.68 0.00 0.02 1.43 6.56 -1.79 1.03 116.57 140.50 2o5j h LYS 111 Ca -0.16 0.00 -0.31 0.00 -1.06 0.00 0.00 60.65 59.12 2o5j h LYS 111 Cb 1.26 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.87 2o5j h LYS 111 CO 1.23 0.00 -1.82 1.51 -2.06 0.00 0.00 179.45 178.31 2o5j n ILE 112 N -3.88 1.63 0.14 1.86 0.13 -1.22 -3.21 119.36 114.79 2o5j n ILE 112 Ca 0.14 -0.77 0.01 0.00 -1.10 0.00 0.00 62.75 61.03 2o5j n ILE 112 Cb 0.89 -1.13 0.10 0.00 -0.84 0.00 0.00 39.64 38.66 2o5j n ILE 112 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 2o5j h GLY 113 N 3.09 0.00 0.00 4.50 0.00 -0.37 -2.15 103.07 108.14 2o5j h GLY 113 Ca -0.33 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 2o5j h GLY 113 CO 0.08 0.00 -0.24 -0.84 0.00 0.00 0.00 176.54 175.53 2o5j h THR 114 N 0.00 1.46 0.59 4.70 2.02 0.66 -3.28 112.91 119.07 2o5j h THR 114 Ca -0.01 -2.19 -0.03 0.00 0.77 0.00 0.00 66.41 64.96 2o5j h THR 114 Cb 1.30 2.85 0.01 0.00 -1.74 0.00 0.00 68.15 70.56 2o5j h THR 114 CO 0.07 0.49 -0.28 0.25 0.37 0.00 0.00 175.52 176.42 2o5j h LEU 115 N -1.00 -0.67 -8.78 2.58 5.85 -1.66 -3.37 115.31 108.25 2o5j h LEU 115 Ca -0.06 0.01 -0.60 0.00 0.84 0.00 0.00 57.88 58.07 2o5j h LEU 115 Cb 0.97 0.17 -0.10 0.00 0.37 0.00 0.00 40.66 42.07 2o5j h LEU 115 CO -0.04 -0.46 0.54 -0.22 -0.34 0.00 0.00 178.44 177.93 2o5j s LEU 116 N -10.01 4.03 -0.84 2.25 0.20 -0.81 -4.95 118.68 108.56 2o5j s LEU 116 Ca -0.17 0.40 -0.25 0.00 0.69 0.00 0.00 54.13 54.81 2o5j s LEU 116 Cb 0.03 -3.19 -0.06 0.00 -0.43 0.00 0.00 46.19 42.55 2o5j s LEU 116 CO 0.61 -0.88 2.00 -0.62 -0.29 0.00 0.00 176.35 177.18 2o5j s ASP 117 N 1.97 4.99 0.24 3.68 2.15 -1.26 -4.38 116.67 124.06 2o5j s ASP 117 Ca 0.36 -0.41 0.04 0.00 0.43 0.00 0.00 52.55 52.97 2o5j s ASP 117 Cb -0.12 -2.55 -0.05 0.00 -0.30 0.00 0.00 42.92 39.90 2o5j s ASP 117 CO 0.20 -2.84 0.01 -0.76 -0.17 0.00 0.00 175.17 171.61 2o5j s LEU 118 N 10.59 2.16 -0.46 -1.34 1.43 -1.23 -4.95 118.68 124.88 2o5j s LEU 118 Ca 0.73 -1.25 -0.26 0.00 -1.03 0.00 0.00 54.13 52.32 2o5j s LEU 118 Cb -0.08 -0.28 -0.06 0.00 0.03 0.00 0.00 46.19 45.80 2o5j s LEU 118 CO 0.04 -0.53 2.34 -0.44 0.23 0.00 0.00 176.35 177.99 2o5j s SER 119 N -3.33 4.65 0.09 2.29 0.01 -1.26 -4.73 113.70 111.42 2o5j s SER 119 Ca 0.30 1.16 0.03 0.00 1.31 0.00 0.00 55.95 58.75 2o5j s SER 119 Cb 0.06 -2.50 0.28 0.00 0.21 0.00 0.00 66.02 64.07 2o5j s SER 119 CO 0.10 -2.70 0.40 0.00 0.41 0.00 0.00 173.24 171.44 2o5j n ALA 120 N 15.03 0.21 0.00 1.44 0.00 -1.26 -1.69 120.51 134.24 2o5j n ALA 120 Ca 0.34 0.26 0.00 0.00 0.00 0.00 0.00 53.44 54.05 2o5j n ALA 120 Cb 0.53 -0.23 0.00 0.00 0.00 0.00 0.00 19.45 19.75 2o5j n ALA 120 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2o5j n THR 121 N -3.78 0.00 -0.10 0.00 -2.24 -1.26 -4.36 114.28 102.54 2o5j n THR 121 Ca 0.08 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.63 2o5j n THR 121 Cb 0.27 -0.73 -0.12 0.00 -2.10 0.00 0.00 70.33 67.66 2o5j n THR 121 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2o5j n GLU 122 N -1.61 0.62 -0.25 -0.78 2.13 -0.83 -3.47 120.64 116.46 2o5j n GLU 122 Ca 0.00 0.37 0.09 0.00 0.66 0.00 0.00 57.16 58.28 2o5j n GLU 122 Cb 0.37 -1.64 0.35 0.00 0.27 0.00 0.00 31.44 30.79 2o5j n GLU 122 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 2o5j h LEU 123 N -0.65 0.69 0.56 4.31 4.07 -1.67 0.38 115.31 123.00 2o5j h LEU 123 Ca -0.50 0.03 -0.03 0.00 0.08 0.00 0.00 57.88 57.46 2o5j h LEU 123 Cb 1.62 -0.12 0.01 0.00 1.08 0.00 0.00 40.66 43.25 2o5j h LEU 123 CO -0.20 0.39 -0.27 -0.08 -1.08 0.00 0.00 178.44 177.21 2o5j h GLU 124 N 0.75 -0.72 -0.19 1.13 4.81 -1.71 -2.46 114.58 116.19 2o5j h GLU 124 Ca 0.41 0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.74 2o5j h GLU 124 Cb 0.53 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 2o5j h GLU 124 CO -0.17 -0.48 0.25 0.37 -0.73 0.00 0.00 179.01 178.25 2o5j h GLN 125 N -0.77 0.00 0.74 1.92 5.75 -1.52 0.17 115.11 121.41 2o5j h GLN 125 Ca -0.08 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.39 2o5j h GLN 125 Cb 0.58 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.13 2o5j h GLN 125 CO 0.13 0.00 -0.36 0.28 -2.65 0.00 0.00 178.83 176.23 2o5j h VAL 126 N 0.00 0.00 0.19 2.39 2.07 -0.47 -3.30 116.25 117.13 2o5j h VAL 126 Ca 0.09 -0.13 -0.32 0.00 0.82 0.00 0.00 66.70 67.16 2o5j h VAL 126 Cb 0.59 0.00 0.03 0.00 -1.52 0.00 0.00 31.29 30.39 2o5j h VAL 126 CO -0.00 0.00 -1.37 0.17 0.02 0.00 0.00 177.57 176.39 2o5j h LEU 127 N -1.12 0.84 -0.16 2.57 8.10 -1.15 -3.16 115.31 121.22 2o5j h LEU 127 Ca -0.10 -0.84 0.02 0.00 0.11 0.00 0.00 57.88 57.07 2o5j h LEU 127 Cb 0.77 -0.27 -0.04 0.00 -0.44 0.00 0.00 40.66 40.68 2o5j h LEU 127 CO 0.17 1.64 -0.29 1.88 -4.11 0.00 0.00 178.44 177.73 2o5j h TYR 128 N 0.20 -0.87 0.00 0.17 0.99 -1.10 0.85 116.97 117.21 2o5j h TYR 128 Ca -0.22 0.04 -0.23 0.00 2.00 0.00 0.00 58.73 60.32 2o5j h TYR 128 Cb 2.05 0.40 -0.04 0.00 1.00 0.00 0.00 36.73 40.15 2o5j h TYR 128 CO 0.12 -0.27 -1.29 0.74 -0.00 0.00 0.00 178.16 177.46 2o5j h PHE 129 N -0.24 0.00 -3.70 4.88 -1.00 -1.76 -3.15 116.94 111.97 2o5j h PHE 129 Ca 0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.81 2o5j h PHE 129 Cb 0.32 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.88 2o5j h PHE 129 CO -0.61 0.90 0.00 0.45 -1.61 0.00 0.00 178.31 177.43 2o5j n SER 130 N -3.15 0.16 -3.57 2.17 2.88 -1.10 -4.65 113.62 106.36 2o5j n SER 130 Ca -0.08 -0.70 -0.41 0.00 -1.33 0.00 0.00 58.87 56.36 2o5j n SER 130 Cb 0.95 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 64.42 2o5j n SER 130 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2o5j n LYS 131 N -0.64 5.07 0.00 -1.46 4.81 -1.26 -2.67 118.16 122.01 2o5j n LYS 131 Ca 0.00 -4.13 0.00 0.00 -0.87 0.00 0.00 58.31 53.31 2o5j n LYS 131 Cb 0.00 -2.54 0.00 0.00 0.02 0.00 0.00 35.03 32.51 2o5j n LYS 131 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2o5j n TYR 132 N 0.73 0.00 -3.79 5.64 4.02 -1.26 -4.59 117.16 117.92 2o5j n TYR 132 Ca 0.54 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 58.34 2o5j n TYR 132 Cb 0.25 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.54 2o5j n TYR 132 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 2o5j s ILE 133 N 3.83 0.02 -0.30 -0.72 -0.00 -1.21 -1.18 121.20 121.63 2o5j s ILE 133 Ca 0.00 -0.89 -0.06 0.00 -0.00 0.00 0.00 60.65 59.70 2o5j s ILE 133 Cb 0.00 -1.72 0.17 0.00 -0.00 0.00 0.00 42.46 40.91 2o5j s ILE 133 CO 0.00 -0.08 0.72 0.68 -0.00 0.00 0.00 174.94 176.26 2o5j s VAL 134 N -3.90 -0.85 -0.09 8.37 -7.23 -1.25 -3.00 120.40 112.45 2o5j s VAL 134 Ca 0.11 0.00 -0.30 0.00 -1.81 0.00 0.00 61.98 59.99 2o5j s VAL 134 Cb -0.02 -1.00 -0.04 0.00 0.56 0.00 0.00 36.38 35.88 2o5j s VAL 134 CO 0.00 0.00 1.44 -0.76 -0.31 0.00 0.00 175.10 175.47 2o5j s LEU 135 N 2.84 4.26 0.00 1.32 1.02 -0.99 -3.20 118.68 123.94 2o5j s LEU 135 Ca 0.09 1.99 0.00 0.00 0.02 0.00 0.00 54.13 56.22 2o5j s LEU 135 Cb -0.13 -3.54 0.00 0.00 0.02 0.00 0.00 46.19 42.54 2o5j s LEU 135 CO -0.19 -0.81 0.00 -0.67 0.02 0.00 0.00 176.35 174.70 2o5j n ASP 136 N 6.50 0.00 0.00 2.29 4.64 -0.89 -3.77 116.55 125.33 2o5j n ASP 136 Ca 0.15 0.26 0.00 0.00 -1.38 0.00 0.00 54.79 53.81 2o5j n ASP 136 Cb 0.44 -0.26 0.00 0.00 -1.04 0.00 0.00 41.12 40.26 2o5j n ASP 136 CO 0.00 0.00 0.00 -2.65 -0.82 0.00 0.00 177.20 173.73 2o5j n PRO 137 N -1.28 0.00 -4.18 -0.67 -0.02 -1.26 -4.74 135.00 122.85 2o5j n PRO 137 Ca 0.00 0.07 -0.17 0.00 -2.02 0.00 0.00 63.50 61.38 2o5j n PRO 137 Cb 0.00 -0.37 -0.11 0.00 -0.02 0.00 0.00 33.50 33.00 2o5j n PRO 137 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2o5j s LYS 138 N -0.39 0.86 -0.49 -0.52 -2.85 -1.26 -4.84 119.74 110.25 2o5j s LYS 138 Ca 0.00 -1.07 0.06 0.00 -1.00 0.00 0.00 55.97 53.95 2o5j s LYS 138 Cb 0.00 -0.72 0.22 0.00 -2.06 0.00 0.00 37.83 35.26 2o5j s LYS 138 CO 0.00 0.14 0.84 0.41 0.10 0.00 0.00 175.35 176.84 2o5j n GLY 139 N 0.89 -0.42 0.35 0.59 0.00 -1.25 -2.88 105.19 102.48 2o5j n GLY 139 Ca -0.18 0.39 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 2o5j n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j n ALA 140 N 2.31 -0.19 -1.43 4.61 0.00 -1.25 -4.27 120.51 120.29 2o5j n ALA 140 Ca 0.13 0.86 -0.37 0.00 0.00 0.00 0.00 53.44 54.06 2o5j n ALA 140 Cb 0.60 -0.35 0.06 0.00 0.00 0.00 0.00 19.45 19.76 2o5j n ALA 140 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2o5j n ILE 141 N -5.27 2.51 -3.29 0.00 -0.00 -1.26 -4.38 119.36 107.68 2o5j n ILE 141 Ca 0.08 -0.46 -0.19 0.00 -0.00 0.00 0.00 62.75 62.18 2o5j n ILE 141 Cb 0.33 -0.84 -0.01 0.00 -0.00 0.00 0.00 39.64 39.13 2o5j n ILE 141 CO 0.00 0.00 0.00 -0.76 -0.00 0.00 0.00 176.55 175.79 2o5j s LEU 142 N -0.52 3.62 -0.03 1.39 1.43 -1.26 -4.27 118.68 119.05 2o5j s LEU 142 Ca 0.70 -0.48 0.09 0.00 -1.03 0.00 0.00 54.13 53.41 2o5j s LEU 142 Cb -0.40 -2.47 -0.14 0.00 0.03 0.00 0.00 46.19 43.21 2o5j s LEU 142 CO 0.53 -0.65 0.17 -0.46 0.23 0.00 0.00 176.35 176.17 2o5j n ASN 143 N -1.70 2.85 0.00 2.29 6.94 -1.26 -4.89 115.26 119.49 2o5j n ASN 143 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.61 2o5j n ASN 143 Cb 0.60 1.29 0.00 0.00 -2.36 0.00 0.00 39.78 39.30 2o5j n ASN 143 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2o5j n GLY 144 N 2.07 0.43 3.42 4.83 0.00 -1.26 -5.12 105.19 109.56 2o5j n GLY 144 Ca -0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.77 2o5j n GLY 144 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j s VAL 145 N 0.00 1.51 1.07 1.61 0.11 -1.26 -5.15 120.40 118.29 2o5j s VAL 145 Ca 0.00 -2.09 -0.14 0.00 -2.93 0.00 0.00 61.98 56.82 2o5j s VAL 145 Cb 0.00 -2.48 0.17 0.00 -1.53 0.00 0.00 36.38 32.55 2o5j s VAL 145 CO 0.00 -0.27 0.70 -0.81 -3.33 0.00 0.00 175.10 171.39 2o5j n PRO 146 N -0.58 -1.47 -1.64 1.54 -0.04 -1.26 -4.49 135.00 127.06 2o5j n PRO 146 Ca -0.05 -0.39 -0.45 0.00 -0.04 0.00 0.00 63.50 62.57 2o5j n PRO 146 Cb 0.64 -2.05 -0.02 0.00 -0.04 0.00 0.00 33.50 32.02 2o5j n PRO 146 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2o5j n VAL 147 N -4.47 1.25 -2.74 0.52 3.14 -1.26 -4.79 118.33 109.98 2o5j n VAL 147 Ca 0.05 -0.31 -0.42 0.00 -2.96 0.00 0.00 64.34 60.69 2o5j n VAL 147 Cb 0.55 -1.29 -0.04 0.00 -1.06 0.00 0.00 33.84 32.01 2o5j n VAL 147 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2o5j s GLU 148 N -0.79 3.31 0.29 1.45 2.02 -1.26 -4.93 118.70 118.79 2o5j s GLU 148 Ca 0.66 -0.25 0.04 0.00 0.02 0.00 0.00 54.97 55.44 2o5j s GLU 148 Cb -0.69 -4.09 0.73 0.00 0.10 0.00 0.00 34.13 30.18 2o5j s GLU 148 CO 0.54 -1.69 1.70 0.87 0.02 0.00 0.00 175.26 176.70 2o5j h LYS 149 N 9.51 0.39 0.00 1.61 6.56 -1.88 -3.31 116.57 129.46 2o5j h LYS 149 Ca -0.27 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.30 2o5j h LYS 149 Cb 1.07 -0.09 0.00 0.00 -0.57 0.00 0.00 32.23 32.64 2o5j h LYS 149 CO 1.15 0.26 0.00 -2.13 -2.06 0.00 0.00 179.45 176.68 2o5j n ARG 150 N -5.04 0.00 -1.39 3.15 0.63 -1.25 -4.37 116.66 108.40 2o5j n ARG 150 Ca 0.22 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.86 2o5j n ARG 150 Cb 0.66 -0.38 0.16 0.00 0.45 0.00 0.00 32.46 33.34 2o5j n ARG 150 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2o5j s GLN 151 N 0.00 0.71 0.08 -0.14 1.11 -1.24 -4.60 119.66 115.58 2o5j s GLN 151 Ca 0.00 0.32 0.06 0.00 0.01 0.00 0.00 55.36 55.75 2o5j s GLN 151 Cb 0.00 -1.79 -0.04 0.00 -1.01 0.00 0.00 33.01 30.17 2o5j s GLN 151 CO 0.00 -2.49 -0.08 -0.48 0.01 0.00 0.00 175.29 172.24 2o5j s LEU 152 N -6.24 3.12 0.00 2.90 2.34 -1.26 -2.36 118.68 117.18 2o5j s LEU 152 Ca 0.65 -0.31 0.06 0.00 0.06 0.00 0.00 54.13 54.59 2o5j s LEU 152 Cb -0.16 -1.88 -0.02 0.00 -0.56 0.00 0.00 46.19 43.57 2o5j s LEU 152 CO 0.55 0.20 0.21 0.00 -1.06 0.00 0.00 176.35 176.25 2o5j n LEU 153 N 0.87 0.00 -4.90 1.48 -0.00 -1.16 -4.91 117.00 108.37 2o5j n LEU 153 Ca -0.13 -3.27 -0.20 0.00 -0.00 0.00 0.00 56.01 52.41 2o5j n LEU 153 Cb 0.52 1.36 -0.02 0.00 -0.00 0.00 0.00 43.42 45.28 2o5j n LEU 153 CO 0.33 -0.52 0.01 0.28 -0.00 0.00 0.00 177.39 177.49 2o5j s THR 154 N -3.26 3.09 0.19 1.47 -1.32 -1.26 -3.29 115.64 111.26 2o5j s THR 154 Ca 0.30 -1.26 -0.12 0.00 -1.21 0.00 0.00 61.69 59.39 2o5j s THR 154 Cb 0.01 -3.09 0.10 0.00 -1.51 0.00 0.00 72.50 68.02 2o5j s THR 154 CO 0.21 -0.06 1.85 -0.78 -2.21 0.00 0.00 174.62 173.63 2o5j h ASP 155 N 1.01 0.73 0.13 8.08 3.58 -1.96 0.17 116.42 128.16 2o5j h ASP 155 Ca -0.42 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.00 2o5j h ASP 155 Cb 1.26 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 42.12 2o5j h ASP 155 CO 0.55 0.54 -0.17 -0.33 -2.88 0.00 0.00 179.24 176.94 2o5j h GLU 156 N 0.85 -0.31 -0.25 0.28 4.39 -1.96 2.37 114.58 119.95 2o5j h GLU 156 Ca 0.23 0.02 0.05 0.00 0.34 0.00 0.00 59.36 60.00 2o5j h GLU 156 Cb -0.08 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2o5j h GLU 156 CO -0.05 -0.20 0.18 0.93 -1.16 0.00 0.00 179.01 178.70 2o5j h GLU 157 N -0.32 0.11 -0.28 2.33 5.08 -1.98 0.16 114.58 119.69 2o5j h GLU 157 Ca -0.02 -0.01 -0.17 0.00 -1.00 0.00 0.00 59.36 58.17 2o5j h GLU 157 Cb 0.28 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 2o5j h GLU 157 CO -0.04 0.07 -0.51 -0.92 -1.00 0.00 0.00 179.01 176.61 2o5j h TYR 158 N 0.12 0.97 0.42 4.33 3.20 -0.03 -3.06 116.97 122.91 2o5j h TYR 158 Ca 0.11 -0.33 -0.02 0.00 3.14 0.00 0.00 58.73 61.63 2o5j h TYR 158 Cb 0.31 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.40 2o5j h TYR 158 CO -0.00 1.12 -0.20 0.00 -1.64 0.00 0.00 178.16 177.44 2o5j h ARG 159 N 0.61 -0.55 -1.02 1.82 3.08 0.67 -2.94 114.38 116.06 2o5j h ARG 159 Ca 0.02 0.04 0.25 0.00 0.07 0.00 0.00 59.98 60.36 2o5j h ARG 159 Cb 1.09 0.12 -0.11 0.00 0.08 0.00 0.00 29.97 31.16 2o5j h ARG 159 CO 0.11 -0.35 0.63 0.93 -1.07 0.00 0.00 179.97 180.22 2o5j h GLU 160 N -0.59 0.50 -0.04 0.04 5.08 -1.03 -3.11 114.58 115.42 2o5j h GLU 160 Ca -0.06 -0.03 -0.25 0.00 -1.00 0.00 0.00 59.36 58.02 2o5j h GLU 160 Cb 0.45 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 29.60 2o5j h GLU 160 CO 0.10 0.33 -0.96 1.25 -1.00 0.00 0.00 179.01 178.72 2o5j h LEU 161 N 0.51 0.85 0.03 1.33 6.46 -1.41 -3.37 115.31 119.70 2o5j h LEU 161 Ca 0.61 -0.65 -0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2o5j h LEU 161 Cb 1.32 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 40.99 2o5j h LEU 161 CO -0.37 1.44 -0.01 -0.09 -0.62 0.00 0.00 178.44 178.79 2o5j h ARG 162 N 0.40 -0.04 0.00 1.25 2.43 -1.55 -3.16 114.38 113.71 2o5j h ARG 162 Ca -0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2o5j h ARG 162 Cb 1.60 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.16 2o5j h ARG 162 CO 0.19 0.68 0.27 0.10 -1.51 0.00 0.00 179.97 179.69 2o5j h TYR 163 N -0.86 0.00 0.00 2.20 -0.00 -1.78 -3.37 116.97 113.16 2o5j h TYR 163 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2o5j h TYR 163 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.46 2o5j h TYR 163 CO 0.18 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.75 2o5j n GLY 164 N -1.20 0.00 0.00 0.10 0.00 -1.20 -4.19 105.19 98.71 2o5j n GLY 164 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2o5j n GLY 164 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2o5j n LYS 165 N -1.63 0.00 -2.03 1.61 5.02 -1.26 -4.79 118.16 115.07 2o5j n LYS 165 Ca 0.00 0.04 -0.43 0.00 -2.02 0.00 0.00 58.31 55.90 2o5j n LYS 165 Cb 0.00 -0.27 -0.03 0.00 -0.02 0.00 0.00 35.03 34.72 2o5j n LYS 165 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 2o5j s GLN 166 N -0.26 3.57 -0.10 1.97 0.74 -1.26 -4.54 119.66 119.78 2o5j s GLN 166 Ca 0.00 1.59 0.02 0.00 0.05 0.00 0.00 55.36 57.02 2o5j s GLN 166 Cb 0.00 -4.12 0.01 0.00 1.10 0.00 0.00 33.01 30.00 2o5j s GLN 166 CO 0.00 -1.57 -0.16 -1.21 -0.55 0.00 0.00 175.29 171.80 2o5j s GLU 167 N 5.17 2.26 -0.00 1.67 2.02 -1.22 -4.96 118.70 123.65 2o5j s GLU 167 Ca 0.77 -0.58 -0.21 0.00 0.02 0.00 0.00 54.97 54.96 2o5j s GLU 167 Cb -0.24 -1.89 -0.05 0.00 0.10 0.00 0.00 34.13 32.04 2o5j s GLU 167 CO 0.32 -0.03 0.61 0.95 0.02 0.00 0.00 175.26 177.13 2o5j s THR 168 N 0.89 4.90 -0.24 3.63 -4.23 -1.26 -2.33 115.64 117.00 2o5j s THR 168 Ca -0.09 1.29 0.02 0.00 -1.18 0.00 0.00 61.69 61.73 2o5j s THR 168 Cb -0.15 -3.95 0.05 0.00 1.34 0.00 0.00 72.50 69.79 2o5j s THR 168 CO -0.00 0.40 -0.12 -0.31 -0.54 0.00 0.00 174.62 174.06 2o5j s TYR 169 N -0.12 3.06 0.46 3.99 1.51 -0.53 -4.98 117.35 120.73 2o5j s TYR 169 Ca 0.32 -2.13 -0.23 0.00 -1.01 0.00 0.00 57.07 54.02 2o5j s TYR 169 Cb -0.18 -1.87 -0.07 0.00 -0.11 0.00 0.00 41.96 39.72 2o5j s TYR 169 CO 0.18 -0.85 1.15 -2.14 -1.11 0.00 0.00 175.55 172.78 2o5j s PRO 170 N 1.18 3.77 -0.14 -1.71 0.02 -1.26 -0.74 135.00 136.11 2o5j s PRO 170 Ca -0.06 1.74 0.02 0.00 0.02 0.00 0.00 61.00 62.71 2o5j s PRO 170 Cb -0.19 -2.39 0.01 0.00 0.02 0.00 0.00 34.50 31.96 2o5j s PRO 170 CO -0.06 -0.54 -0.19 -0.51 -0.33 0.00 0.00 177.00 175.37 2o5j s LEU 171 N -3.05 1.95 0.30 -5.54 1.43 -0.16 -4.86 118.68 108.75 2o5j s LEU 171 Ca 0.64 -0.55 -0.28 0.00 -1.03 0.00 0.00 54.13 52.91 2o5j s LEU 171 Cb -0.28 -1.32 -0.14 0.00 0.03 0.00 0.00 46.19 44.49 2o5j s LEU 171 CO 0.33 0.03 1.05 -0.81 0.23 0.00 0.00 176.35 177.19 2o5j n PRO 172 N 4.27 1.46 -1.63 1.29 -0.04 -1.26 -4.71 135.00 134.38 2o5j n PRO 172 Ca -0.19 0.51 -0.42 0.00 -0.04 0.00 0.00 63.50 63.36 2o5j n PRO 172 Cb 0.51 -1.91 0.01 0.00 -0.04 0.00 0.00 33.50 32.07 2o5j n PRO 172 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2o5j n PRO 173 N 0.69 1.48 -0.68 0.54 -0.04 -1.26 -1.68 135.00 134.05 2o5j n PRO 173 Ca 0.09 0.53 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 2o5j n PRO 173 Cb 0.33 -2.10 0.00 0.00 -0.04 0.00 0.00 33.50 31.69 2o5j n PRO 173 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2o5j n GLY 174 N 1.10 1.58 3.73 0.55 0.00 -1.26 -5.02 105.19 105.87 2o5j n GLY 174 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 2o5j n GLY 174 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 175 N -3.66 5.35 0.22 1.61 1.01 -0.68 -5.09 120.40 119.17 2o5j s VAL 175 Ca 0.00 0.39 -0.11 0.00 0.00 0.00 0.00 61.98 62.26 2o5j s VAL 175 Cb 0.00 -3.56 -0.07 0.00 0.00 0.00 0.00 36.38 32.74 2o5j s VAL 175 CO 0.00 0.41 0.57 -0.62 0.00 0.00 0.00 175.10 175.46 2o5j s ASP 176 N 0.45 6.69 0.63 3.32 3.68 -1.26 -4.86 116.67 125.32 2o5j s ASP 176 Ca 0.13 1.00 -0.03 0.00 2.13 0.00 0.00 52.55 55.77 2o5j s ASP 176 Cb -0.12 -2.26 0.04 0.00 -1.45 0.00 0.00 42.92 39.14 2o5j s ASP 176 CO 0.01 -0.05 0.91 0.00 0.13 0.00 0.00 175.17 176.17 2o5j s ALA 177 N -1.76 3.46 -0.20 3.66 0.00 -1.26 -4.45 121.76 121.21 2o5j s ALA 177 Ca 0.46 -1.06 0.16 0.00 0.00 0.00 0.00 51.96 51.52 2o5j s ALA 177 Cb -0.12 -2.40 0.59 0.00 0.00 0.00 0.00 23.12 21.20 2o5j s ALA 177 CO 0.20 -1.03 1.50 1.28 0.00 0.00 0.00 175.76 177.71 2o5j n LEU 178 N -2.66 4.31 -4.02 0.00 4.77 -1.12 -4.90 117.00 113.37 2o5j n LEU 178 Ca 0.07 -3.04 -0.10 0.00 -0.03 0.00 0.00 56.01 52.91 2o5j n LEU 178 Cb 0.60 -0.58 -0.11 0.00 -2.33 0.00 0.00 43.42 41.00 2o5j n LEU 178 CO 0.49 0.69 -0.37 -0.69 -1.33 0.00 0.00 177.39 176.18 2o5j s VAL 179 N -2.84 0.27 0.52 4.08 1.01 -1.26 -4.94 120.40 117.23 2o5j s VAL 179 Ca 0.45 -1.07 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 2o5j s VAL 179 Cb 0.36 -0.52 -0.02 0.00 0.00 0.00 0.00 36.38 36.20 2o5j s VAL 179 CO 0.10 -0.52 0.82 -0.54 0.00 0.00 0.00 175.10 174.96 2o5j s LYS 180 N -1.78 3.32 0.26 2.72 3.01 -1.26 -4.95 119.74 121.05 2o5j s LYS 180 Ca -0.11 0.11 0.15 0.00 -1.01 0.00 0.00 55.97 55.11 2o5j s LYS 180 Cb -0.08 -2.34 0.93 0.00 -1.01 0.00 0.00 37.83 35.33 2o5j s LYS 180 CO -0.01 -0.38 1.09 -3.47 0.51 0.00 0.00 175.35 173.09 2o5j n ASP 181 N -2.37 0.24 -2.32 2.83 -0.08 -1.26 -1.48 116.55 112.11 2o5j n ASP 181 Ca 0.02 1.15 0.01 0.00 -1.51 0.00 0.00 54.79 54.46 2o5j n ASP 181 Cb 0.56 -0.56 0.04 0.00 2.34 0.00 0.00 41.12 43.50 2o5j n ASP 181 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2o5j n GLY 182 N -1.18 1.49 3.80 0.27 0.00 -1.08 -2.98 105.19 105.51 2o5j n GLY 182 Ca 0.26 -0.92 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 2o5j n GLY 182 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o5j s GLU 183 N -2.22 3.50 -0.15 1.61 2.12 -0.55 -4.70 118.70 118.31 2o5j s GLU 183 Ca 0.28 1.23 -0.29 0.00 0.36 0.00 0.00 54.97 56.55 2o5j s GLU 183 Cb 0.34 -2.06 -0.02 0.00 0.26 0.00 0.00 34.13 32.66 2o5j s GLU 183 CO -0.09 -0.66 1.25 -1.21 -0.54 0.00 0.00 175.26 174.01 2o5j s GLU 184 N -3.84 4.25 -0.07 4.30 0.41 -1.26 -1.54 118.70 120.96 2o5j s GLU 184 Ca 0.64 1.66 0.03 0.00 -0.41 0.00 0.00 54.97 56.89 2o5j s GLU 184 Cb -0.16 -3.73 -0.02 0.00 -1.78 0.00 0.00 34.13 28.44 2o5j s GLU 184 CO 0.32 -0.66 -0.15 0.08 -0.49 0.00 0.00 175.26 174.36 2o5j s VAL 185 N 3.28 3.01 0.21 2.63 1.01 -0.13 -4.94 120.40 125.46 2o5j s VAL 185 Ca 0.55 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.87 2o5j s VAL 185 Cb -0.22 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 2o5j s VAL 185 CO 0.16 0.58 0.06 -0.69 0.00 0.00 0.00 175.10 175.20 2o5j s VAL 186 N -0.47 3.91 -0.19 2.92 1.01 -1.26 -1.02 120.40 125.30 2o5j s VAL 186 Ca 0.06 -1.47 -0.35 0.00 0.00 0.00 0.00 61.98 60.21 2o5j s VAL 186 Cb -0.12 -3.03 -0.12 0.00 0.00 0.00 0.00 36.38 33.11 2o5j s VAL 186 CO 0.02 -0.21 1.93 1.17 0.00 0.00 0.00 175.10 178.01 2o5j n LYS 187 N -0.52 1.71 0.00 2.72 4.81 -1.25 -1.12 118.16 124.51 2o5j n LYS 187 Ca -0.08 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 2o5j n LYS 187 Cb 0.56 -2.52 0.00 0.00 0.02 0.00 0.00 35.03 33.10 2o5j n LYS 187 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2o5j n GLY 188 N 4.86 0.67 3.77 3.14 0.00 -0.09 -4.93 105.19 112.60 2o5j n GLY 188 Ca 0.28 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.91 2o5j n GLY 188 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2o5j s GLN 189 N -0.90 4.36 -0.31 1.61 -0.44 -0.28 -4.63 119.66 119.08 2o5j s GLN 189 Ca 0.00 1.73 -0.29 0.00 -2.50 0.00 0.00 55.36 54.30 2o5j s GLN 189 Cb 0.00 -2.88 -0.00 0.00 -1.64 0.00 0.00 33.01 28.49 2o5j s GLN 189 CO 0.00 -0.02 1.38 -1.21 0.50 0.00 0.00 175.29 175.94 2o5j s GLU 190 N -1.96 3.83 0.00 1.67 2.02 -1.26 -0.49 118.70 122.51 2o5j s GLU 190 Ca 0.51 1.27 0.28 0.00 0.02 0.00 0.00 54.97 57.05 2o5j s GLU 190 Cb -0.29 -3.94 1.15 0.00 0.10 0.00 0.00 34.13 31.16 2o5j s GLU 190 CO 0.37 -1.24 1.81 1.28 0.02 0.00 0.00 175.26 177.49 2o5j n LEU 191 N 8.02 0.79 0.00 1.80 4.77 -1.04 -4.55 117.00 126.79 2o5j n LEU 191 Ca 0.16 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2o5j n LEU 191 Cb 0.47 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2o5j n LEU 191 CO 0.65 0.14 0.00 0.00 -1.33 0.00 0.00 177.39 176.85 2o5j n ALA 192 N -0.63 0.00 -0.29 -1.18 0.00 -1.21 -2.81 120.51 114.40 2o5j n ALA 192 Ca 0.16 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.68 2o5j n ALA 192 Cb 0.29 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.94 2o5j n ALA 192 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2o5j h PRO 193 N 0.00 0.08 0.01 0.00 0.13 -1.92 -2.93 132.00 127.37 2o5j h PRO 193 Ca 0.00 -0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.79 2o5j h PRO 193 Cb 0.00 -0.02 -0.06 0.00 0.13 0.00 0.00 31.00 31.06 2o5j h PRO 193 CO 0.00 0.05 -2.04 0.41 -0.23 0.00 0.00 178.00 176.20 2o5j n GLY 194 N -1.45 -0.92 3.79 1.56 0.00 -1.26 -4.96 105.19 101.95 2o5j n GLY 194 Ca 0.16 -0.18 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 2o5j n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 195 N -2.55 4.34 -0.03 1.61 1.01 -1.11 -5.06 120.40 118.61 2o5j s VAL 195 Ca -0.10 1.65 -0.01 0.00 0.00 0.00 0.00 61.98 63.52 2o5j s VAL 195 Cb 0.07 -3.99 0.03 0.00 0.00 0.00 0.00 36.38 32.49 2o5j s VAL 195 CO 0.81 0.23 0.05 -0.69 0.00 0.00 0.00 175.10 175.50 2o5j s VAL 196 N -1.51 -0.07 0.54 2.92 1.01 -1.26 -2.49 120.40 119.54 2o5j s VAL 196 Ca 0.46 0.25 -0.21 0.00 0.00 0.00 0.00 61.98 62.48 2o5j s VAL 196 Cb -0.19 -0.12 -0.05 0.00 0.00 0.00 0.00 36.38 36.02 2o5j s VAL 196 CO 0.24 0.10 1.23 -0.44 0.00 0.00 0.00 175.10 176.23 2o5j s SER 197 N 1.29 5.55 0.00 3.32 0.01 0.36 -4.91 113.70 119.31 2o5j s SER 197 Ca -0.07 2.45 0.07 0.00 1.31 0.00 0.00 55.95 59.71 2o5j s SER 197 Cb -0.13 -2.61 0.04 0.00 0.21 0.00 0.00 66.02 63.53 2o5j s SER 197 CO -0.03 -1.36 0.66 0.54 0.41 0.00 0.00 173.24 173.45 2o5j n ARG 198 N -1.08 0.66 -3.69 12.44 1.74 -1.26 -0.92 116.66 124.55 2o5j n ARG 198 Ca 0.11 -0.79 -0.12 0.00 -0.77 0.00 0.00 57.85 56.28 2o5j n ARG 198 Cb 0.48 -1.08 -0.06 0.00 -1.02 0.00 0.00 32.46 30.77 2o5j n ARG 198 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2o5j s LEU 199 N -0.81 0.55 0.57 0.55 0.20 -1.26 -4.77 118.68 113.70 2o5j s LEU 199 Ca 0.07 -0.13 -0.17 0.00 0.69 0.00 0.00 54.13 54.59 2o5j s LEU 199 Cb 0.06 1.65 -0.05 0.00 -0.43 0.00 0.00 46.19 47.42 2o5j s LEU 199 CO 0.11 -0.69 1.07 -1.81 -0.29 0.00 0.00 176.35 174.73 2o5j s ASP 200 N -2.20 5.85 0.00 3.68 1.01 -1.26 -3.90 116.67 119.84 2o5j s ASP 200 Ca -0.03 1.90 0.00 0.00 0.71 0.00 0.00 52.55 55.13 2o5j s ASP 200 Cb -0.00 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.38 2o5j s ASP 200 CO -0.05 -1.12 0.00 0.61 0.21 0.00 0.00 175.17 174.82 2o5j n GLY 201 N -0.64 0.12 3.39 0.21 0.00 -0.19 -4.66 105.19 103.42 2o5j n GLY 201 Ca 0.09 -1.44 -0.33 0.00 0.00 0.00 0.00 46.02 44.34 2o5j n GLY 201 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 202 N -3.00 3.00 -0.23 1.61 1.01 -0.92 -0.96 120.40 120.92 2o5j s VAL 202 Ca 0.00 -0.69 -0.28 0.00 0.00 0.00 0.00 61.98 61.00 2o5j s VAL 202 Cb 0.00 -2.24 0.01 0.00 0.00 0.00 0.00 36.38 34.15 2o5j s VAL 202 CO 0.00 0.54 1.00 0.00 0.00 0.00 0.00 175.10 176.64 2o5j s ALA 203 N 0.09 3.68 -0.03 5.51 0.00 -0.59 -1.73 121.76 128.69 2o5j s ALA 203 Ca -0.06 0.13 0.05 0.00 0.00 0.00 0.00 51.96 52.07 2o5j s ALA 203 Cb -0.15 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.45 2o5j s ALA 203 CO 0.05 -1.01 -0.16 -0.51 0.00 0.00 0.00 175.76 174.13 2o5j s LEU 204 N 3.10 2.67 -0.02 0.00 1.43 -1.14 -2.63 118.68 122.10 2o5j s LEU 204 Ca 0.42 -0.26 -0.19 0.00 -1.03 0.00 0.00 54.13 53.08 2o5j s LEU 204 Cb -0.15 -1.54 -0.05 0.00 0.03 0.00 0.00 46.19 44.47 2o5j s LEU 204 CO 0.07 0.33 0.53 -0.31 0.23 0.00 0.00 176.35 177.19 2o5j s TYR 205 N -0.77 3.66 -0.45 0.29 1.51 -1.16 -1.02 117.35 119.42 2o5j s TYR 205 Ca 0.12 1.10 -0.11 0.00 -1.01 0.00 0.00 57.07 57.17 2o5j s TYR 205 Cb -0.11 -2.52 0.09 0.00 -0.11 0.00 0.00 41.96 39.31 2o5j s TYR 205 CO 0.01 0.39 0.31 1.03 -1.11 0.00 0.00 175.55 176.19 2o5j s ARG 206 N -0.26 2.67 0.00 -0.62 1.81 -0.33 -4.93 118.95 117.28 2o5j s ARG 206 Ca 0.28 -1.52 0.00 0.00 -1.72 0.00 0.00 55.73 52.77 2o5j s ARG 206 Cb -0.17 -3.90 0.00 0.00 -0.45 0.00 0.00 34.95 30.42 2o5j s ARG 206 CO 0.15 -1.04 0.00 1.19 -0.68 0.00 0.00 175.30 174.92 2o5j n PHE 207 N 4.98 0.00 0.00 -0.53 0.99 -1.26 -3.44 117.46 118.20 2o5j n PHE 207 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.35 2o5j n PHE 207 Cb 0.42 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.90 2o5j n PHE 207 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2o5j n ALA 391 N 0.00 0.00 -3.54 4.37 0.00 -1.26 -5.16 120.51 114.92 2o5j n ALA 391 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2o5j n ALA 391 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 2o5j n ALA 391 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2o5j s SER 392 N -0.14 -0.52 -0.27 0.00 1.04 -1.22 -0.99 113.70 111.60 2o5j s SER 392 Ca 0.00 0.53 -0.03 0.00 0.48 0.00 0.00 55.95 56.93 2o5j s SER 392 Cb 0.00 0.43 0.02 0.00 0.10 0.00 0.00 66.02 66.57 2o5j s SER 392 CO 0.00 -0.50 -0.01 -0.63 0.98 0.00 0.00 173.24 173.07 2o5j s ILE 393 N -1.31 3.24 -0.77 -1.02 1.01 0.08 -1.19 121.20 121.24 2o5j s ILE 393 Ca -0.06 -0.93 -0.19 0.00 0.00 0.00 0.00 60.65 59.46 2o5j s ILE 393 Cb -0.00 -2.66 0.12 0.00 0.01 0.00 0.00 42.46 39.92 2o5j s ILE 393 CO 0.05 0.15 0.95 -1.48 0.00 0.00 0.00 174.94 174.60 2o5j s LEU 394 N 1.38 5.12 -1.05 2.97 2.34 -0.19 -1.45 118.68 127.80 2o5j s LEU 394 Ca 0.01 -1.68 -0.26 0.00 0.06 0.00 0.00 54.13 52.25 2o5j s LEU 394 Cb -0.17 -2.36 -0.19 0.00 -0.56 0.00 0.00 46.19 42.91 2o5j s LEU 394 CO -0.02 -1.13 2.13 -0.69 -1.06 0.00 0.00 176.35 175.58 2o5j s VAL 395 N 2.82 3.10 -0.31 1.48 1.01 -0.98 -2.87 120.40 124.65 2o5j s VAL 395 Ca 0.23 -0.16 -0.28 0.00 0.00 0.00 0.00 61.98 61.77 2o5j s VAL 395 Cb -0.13 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.34 2o5j s VAL 395 CO -0.01 -0.20 1.02 -0.69 0.00 0.00 0.00 175.10 175.23 2o5j s VAL 396 N 15.80 4.58 -0.72 2.92 1.01 -0.71 -3.36 120.40 139.91 2o5j s VAL 396 Ca 0.81 1.67 -0.11 0.00 0.00 0.00 0.00 61.98 64.36 2o5j s VAL 396 Cb -0.06 -4.36 -0.09 0.00 0.00 0.00 0.00 36.38 31.88 2o5j s VAL 396 CO 0.15 -0.40 1.90 1.17 0.00 0.00 0.00 175.10 177.92 2o5j n LYS 397 N 6.68 1.57 -4.52 2.72 4.81 -1.26 -2.17 118.16 126.00 2o5j n LYS 397 Ca 0.10 -1.42 -0.22 0.00 -0.87 0.00 0.00 58.31 55.90 2o5j n LYS 397 Cb 0.47 -2.52 -0.14 0.00 0.02 0.00 0.00 35.03 32.86 2o5j n LYS 397 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2o5j s ALA 398 N 4.20 1.27 -0.15 3.14 0.00 -1.19 -2.87 121.76 126.15 2o5j s ALA 398 Ca 0.41 -0.78 -0.14 0.00 0.00 0.00 0.00 51.96 51.45 2o5j s ALA 398 Cb 0.10 -0.25 -0.05 0.00 0.00 0.00 0.00 23.12 22.92 2o5j s ALA 398 CO 0.03 0.27 0.29 1.03 0.00 0.00 0.00 175.76 177.38 2o5j s ARG 399 N -0.83 4.22 -0.89 0.00 0.52 -1.26 -2.71 118.95 118.00 2o5j s ARG 399 Ca 0.04 0.10 -0.22 0.00 -0.52 0.00 0.00 55.73 55.12 2o5j s ARG 399 Cb -0.07 -3.41 0.07 0.00 0.52 0.00 0.00 34.95 32.06 2o5j s ARG 399 CO 0.01 0.27 1.24 0.54 0.02 0.00 0.00 175.30 177.38 2o5j s VAL 400 N 0.36 4.19 -0.57 3.52 0.11 -1.26 -3.67 120.40 123.08 2o5j s VAL 400 Ca 0.17 -0.74 -0.25 0.00 -2.93 0.00 0.00 61.98 58.23 2o5j s VAL 400 Cb -0.13 -4.89 0.04 0.00 -1.53 0.00 0.00 36.38 29.87 2o5j s VAL 400 CO 0.04 -1.72 1.00 -0.31 -3.33 0.00 0.00 175.10 170.79 2o5j s TYR 401 N 4.27 2.73 0.47 1.54 1.51 -0.89 -4.90 117.35 122.09 2o5j s TYR 401 Ca 0.36 0.02 -0.22 0.00 -1.01 0.00 0.00 57.07 56.22 2o5j s TYR 401 Cb -0.06 -4.19 -0.07 0.00 -0.11 0.00 0.00 41.96 37.53 2o5j s TYR 401 CO -0.02 -1.45 1.14 -2.14 -1.11 0.00 0.00 175.55 171.97 2o5j s PRO 402 N 4.21 3.72 -0.02 -1.71 0.02 -1.26 -2.06 135.00 137.90 2o5j s PRO 402 Ca 0.32 1.69 0.01 0.00 0.02 0.00 0.00 61.00 63.05 2o5j s PRO 402 Cb -0.12 -2.32 0.01 0.00 0.02 0.00 0.00 34.50 32.09 2o5j s PRO 402 CO 0.19 -0.57 -0.05 -0.59 -0.33 0.00 0.00 177.00 175.66 2o5j s PHE 403 N -1.63 0.53 -0.16 6.54 -0.12 -1.22 -4.93 117.98 116.99 2o5j s PHE 403 Ca 0.65 -0.11 0.18 0.00 -0.05 0.00 0.00 56.93 57.60 2o5j s PHE 403 Cb -0.26 -0.41 -0.25 0.00 -0.63 0.00 0.00 43.02 41.46 2o5j s PHE 403 CO 0.31 -0.07 0.23 0.39 -0.05 0.00 0.00 175.22 176.03 2o5j n GLU 404 N 3.37 0.68 -4.04 1.99 1.02 -1.26 -4.77 120.64 117.63 2o5j n GLU 404 Ca -0.18 0.02 -0.23 0.00 -0.02 0.00 0.00 57.16 56.75 2o5j n GLU 404 Cb 0.55 -1.57 -0.04 0.00 -0.02 0.00 0.00 31.44 30.37 2o5j n GLU 404 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2o5j s ASP 405 N -5.48 5.90 0.95 1.62 2.15 -1.26 -5.09 116.67 115.47 2o5j s ASP 405 Ca -0.09 -0.06 -0.15 0.00 0.43 0.00 0.00 52.55 52.68 2o5j s ASP 405 Cb 0.07 -1.63 -0.08 0.00 -0.30 0.00 0.00 42.92 40.98 2o5j s ASP 405 CO 0.84 -0.01 -0.28 -0.67 -0.17 0.00 0.00 175.17 174.87 2o5j n ASP 406 N -0.97 -4.32 -4.85 -0.34 4.64 -1.26 -3.90 116.55 105.56 2o5j n ASP 406 Ca -0.08 0.27 -0.35 0.00 -1.38 0.00 0.00 54.79 53.25 2o5j n ASP 406 Cb 0.56 -0.95 -0.06 0.00 -1.04 0.00 0.00 41.12 39.64 2o5j n ASP 406 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 2o5j s VAL 407 N -2.14 4.93 -0.03 5.18 1.01 -1.26 -1.91 120.40 126.18 2o5j s VAL 407 Ca 0.48 0.69 0.22 0.00 0.00 0.00 0.00 61.98 63.37 2o5j s VAL 407 Cb -0.21 -3.70 -0.34 0.00 0.00 0.00 0.00 36.38 32.13 2o5j s VAL 407 CO 0.76 0.24 0.48 1.21 0.00 0.00 0.00 175.10 177.79 2o5j n GLU 408 N 0.79 0.66 -3.51 2.72 4.07 0.24 -4.93 120.64 120.68 2o5j n GLU 408 Ca -0.06 -0.20 -0.31 0.00 -0.06 0.00 0.00 57.16 56.54 2o5j n GLU 408 Cb 0.52 -1.52 -0.04 0.00 -0.06 0.00 0.00 31.44 30.34 2o5j n GLU 408 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 2o5j s VAL 409 N -3.51 5.06 0.07 6.31 1.01 -1.06 -5.02 120.40 123.26 2o5j s VAL 409 Ca -0.08 0.15 0.09 0.00 0.00 0.00 0.00 61.98 62.14 2o5j s VAL 409 Cb 0.14 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 2o5j s VAL 409 CO 0.91 -0.10 -0.22 -0.94 0.00 0.00 0.00 175.10 174.75 2o5j s SER 410 N -2.64 3.58 -0.08 3.32 1.04 -1.26 -4.92 113.70 112.74 2o5j s SER 410 Ca 0.44 -0.55 -0.34 0.00 0.48 0.00 0.00 55.95 55.98 2o5j s SER 410 Cb -0.11 -0.45 -0.12 0.00 0.10 0.00 0.00 66.02 65.44 2o5j s SER 410 CO 0.25 0.23 1.88 0.41 0.98 0.00 0.00 173.24 176.99 2o5j n THR 411 N 1.35 0.58 0.00 2.02 -1.04 -1.26 -2.26 114.28 113.67 2o5j n THR 411 Ca -0.17 -0.10 0.00 0.00 -2.04 0.00 0.00 64.05 61.74 2o5j n THR 411 Cb 0.52 -1.90 0.00 0.00 -1.82 0.00 0.00 70.33 67.14 2o5j n THR 411 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2o5j n GLY 412 N 4.40 1.44 3.73 3.41 0.00 0.61 -4.97 105.19 113.81 2o5j n GLY 412 Ca 0.22 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 2o5j n GLY 412 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2o5j s ASP 413 N -0.53 4.68 0.17 1.61 2.15 -0.96 -4.53 116.67 119.26 2o5j s ASP 413 Ca 0.00 2.62 -0.09 0.00 0.43 0.00 0.00 52.55 55.50 2o5j s ASP 413 Cb 0.00 -2.62 -0.07 0.00 -0.30 0.00 0.00 42.92 39.94 2o5j s ASP 413 CO 0.00 -1.96 0.49 -0.13 -0.17 0.00 0.00 175.17 173.40 2o5j s ARG 414 N -3.35 3.78 0.22 4.34 3.00 -1.26 -1.98 118.95 123.71 2o5j s ARG 414 Ca 0.82 0.21 0.04 0.00 0.00 0.00 0.00 55.73 56.79 2o5j s ARG 414 Cb -0.37 -2.79 -0.05 0.00 0.00 0.00 0.00 34.95 31.74 2o5j s ARG 414 CO 0.40 0.41 -0.02 0.08 0.00 0.00 0.00 175.30 176.17 2o5j s VAL 415 N -1.67 1.08 0.18 3.52 1.01 0.35 -4.94 120.40 119.93 2o5j s VAL 415 Ca 0.42 -2.04 0.02 0.00 0.00 0.00 0.00 61.98 60.38 2o5j s VAL 415 Cb -0.12 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 33.91 2o5j s VAL 415 CO 0.21 -0.37 0.01 0.00 0.00 0.00 0.00 175.10 174.95 2o5j s ALA 416 N -3.39 1.42 -0.22 5.51 0.00 -1.26 -1.96 121.76 121.86 2o5j s ALA 416 Ca 0.27 -1.63 -0.28 0.00 0.00 0.00 0.00 51.96 50.32 2o5j s ALA 416 Cb 0.05 0.58 -0.05 0.00 0.00 0.00 0.00 23.12 23.70 2o5j s ALA 416 CO 0.08 -0.32 2.15 -2.14 0.00 0.00 0.00 175.76 175.53 2o5j s PRO 417 N -3.92 3.21 0.00 0.00 0.02 -1.26 -2.31 135.00 130.74 2o5j s PRO 417 Ca 0.25 1.99 0.00 0.00 0.02 0.00 0.00 61.00 63.26 2o5j s PRO 417 Cb 0.06 -4.34 0.00 0.00 0.02 0.00 0.00 34.50 30.24 2o5j s PRO 417 CO 0.05 -2.02 0.00 0.41 -0.33 0.00 0.00 177.00 175.12 2o5j n GLY 418 N 5.65 3.54 3.61 0.52 0.00 -0.31 -4.99 105.19 113.21 2o5j n GLY 418 Ca 0.28 -0.99 -0.54 0.00 0.00 0.00 0.00 46.02 44.77 2o5j n GLY 418 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2o5j n ASP 419 N 0.00 1.58 -4.73 1.61 9.92 -0.98 -4.32 116.55 119.63 2o5j n ASP 419 Ca 0.00 1.12 -0.39 0.00 -0.53 0.00 0.00 54.79 54.98 2o5j n ASP 419 Cb 0.00 -1.14 0.03 0.00 -0.64 0.00 0.00 41.12 39.37 2o5j n ASP 419 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2o5j n VAL 420 N 2.82 3.34 0.00 2.53 0.31 -1.26 -1.12 118.33 124.95 2o5j n VAL 420 Ca 0.20 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 2o5j n VAL 420 Cb 0.16 -1.64 0.00 0.00 -0.91 0.00 0.00 33.84 31.45 2o5j n VAL 420 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2o5j n LEU 421 N -0.55 1.97 -3.73 7.52 4.77 0.31 -4.67 117.00 122.62 2o5j n LEU 421 Ca 0.09 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2o5j n LEU 421 Cb 0.43 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2o5j n LEU 421 CO 0.55 0.33 0.93 0.00 -1.33 0.00 0.00 177.39 177.88 2o5j s ALA 422 N -1.78 -2.01 -1.40 -1.18 0.00 -1.08 -0.59 121.76 113.74 2o5j s ALA 422 Ca 0.00 0.33 -0.09 0.00 0.00 0.00 0.00 51.96 52.20 2o5j s ALA 422 Cb 0.00 0.54 0.03 0.00 0.00 0.00 0.00 23.12 23.70 2o5j s ALA 422 CO 0.00 -1.06 1.06 -0.25 0.00 0.00 0.00 175.76 175.51 2o5j n ASP 423 N -0.63 -5.00 0.00 0.00 8.00 -0.80 -2.16 116.55 115.95 2o5j n ASP 423 Ca -0.06 -0.65 0.00 0.00 0.71 0.00 0.00 54.79 54.79 2o5j n ASP 423 Cb 0.61 -4.59 0.00 0.00 -0.02 0.00 0.00 41.12 37.12 2o5j n ASP 423 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2o5j n GLY 424 N -1.78 0.47 0.08 0.44 0.00 -1.26 -2.79 105.19 100.35 2o5j n GLY 424 Ca -0.04 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.16 2o5j n GLY 424 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o5j n GLY 425 N 0.00 -0.66 0.07 -0.02 0.00 -1.26 -4.11 105.19 99.21 2o5j n GLY 425 Ca 0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 2o5j n GLY 425 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2o5j h LYS 426 N 0.10 -0.05 -4.76 1.61 3.64 -1.68 -3.41 116.57 112.01 2o5j h LYS 426 Ca 0.00 0.00 -0.70 0.00 -1.27 0.00 0.00 60.65 58.68 2o5j h LYS 426 Cb 0.08 0.01 -0.19 0.00 -0.41 0.00 0.00 32.23 31.72 2o5j h LYS 426 CO 0.00 0.41 -0.03 0.08 -2.27 0.00 0.00 179.45 177.64 2o5j s VAL 427 N -4.24 4.95 0.18 2.00 1.01 -0.92 -5.05 120.40 118.33 2o5j s VAL 427 Ca -0.15 -0.71 0.10 0.00 0.00 0.00 0.00 61.98 61.21 2o5j s VAL 427 Cb 0.02 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 2o5j s VAL 427 CO 0.65 -0.81 -0.14 -0.54 0.00 0.00 0.00 175.10 174.25 2o5j s LYS 428 N 2.41 1.88 0.57 2.72 1.02 -1.26 0.11 119.74 127.19 2o5j s LYS 428 Ca 0.12 -1.34 -0.11 0.00 0.02 0.00 0.00 55.97 54.66 2o5j s LYS 428 Cb -0.21 -2.06 -0.05 0.00 -0.52 0.00 0.00 37.83 34.99 2o5j s LYS 428 CO 0.10 0.43 0.97 -1.12 -0.92 0.00 0.00 175.35 174.81 2o5j s SER 429 N -2.74 6.32 -0.00 2.83 0.01 -0.27 -4.89 113.70 114.96 2o5j s SER 429 Ca 0.23 1.36 0.05 0.00 1.31 0.00 0.00 55.95 58.90 2o5j s SER 429 Cb -0.09 -2.44 -0.06 0.00 0.21 0.00 0.00 66.02 63.65 2o5j s SER 429 CO 0.13 -0.75 0.18 0.47 0.41 0.00 0.00 173.24 173.68 2o5j n ASP 430 N -2.39 1.05 -4.19 2.44 8.00 -1.26 -1.16 116.55 119.04 2o5j n ASP 430 Ca 0.05 -0.47 -0.11 0.00 0.71 0.00 0.00 54.79 54.96 2o5j n ASP 430 Cb 0.54 1.05 -0.10 0.00 -0.02 0.00 0.00 41.12 42.59 2o5j n ASP 430 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2o5j s VAL 431 N -1.65 0.68 0.39 2.53 1.01 -1.26 -4.49 120.40 117.61 2o5j s VAL 431 Ca 0.01 -1.95 -0.20 0.00 0.00 0.00 0.00 61.98 59.84 2o5j s VAL 431 Cb 0.03 -1.82 -0.10 0.00 0.00 0.00 0.00 36.38 34.49 2o5j s VAL 431 CO 0.20 -0.75 0.89 -0.31 0.00 0.00 0.00 175.10 175.13 2o5j s TYR 432 N -3.64 3.36 -5.00 5.22 1.51 -1.26 -4.15 117.35 113.39 2o5j s TYR 432 Ca 0.16 1.52 0.00 0.00 -1.01 0.00 0.00 57.07 57.74 2o5j s TYR 432 Cb 0.05 -2.77 0.00 0.00 -0.11 0.00 0.00 41.96 39.13 2o5j s TYR 432 CO -0.02 -0.03 0.00 0.41 -1.11 0.00 0.00 175.55 174.80 2o5j n GLY 433 N -0.46 -0.71 3.81 0.71 0.00 -0.83 -3.67 105.19 104.04 2o5j n GLY 433 Ca 0.06 -1.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 2o5j n GLY 433 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o5j s ARG 434 N -1.47 2.42 0.04 1.61 1.81 -1.26 -0.50 118.95 121.60 2o5j s ARG 434 Ca 0.00 0.79 0.09 0.00 -1.72 0.00 0.00 55.73 54.89 2o5j s ARG 434 Cb 0.00 -1.94 -0.03 0.00 -0.45 0.00 0.00 34.95 32.53 2o5j s ARG 434 CO 0.00 -1.42 -0.25 0.08 -0.68 0.00 0.00 175.30 173.03 2o5j s VAL 435 N -3.10 2.00 -0.26 3.52 1.01 -0.83 -0.78 120.40 121.96 2o5j s VAL 435 Ca 0.60 -1.30 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 2o5j s VAL 435 Cb -0.14 -1.71 0.09 0.00 0.00 0.00 0.00 36.38 34.61 2o5j s VAL 435 CO 0.55 0.36 0.10 -1.61 0.00 0.00 0.00 175.10 174.49 2o5j s GLU 436 N -1.13 0.38 -1.08 2.72 8.01 -0.95 -0.28 118.70 126.36 2o5j s GLU 436 Ca 0.10 -0.59 -0.18 0.00 0.01 0.00 0.00 54.97 54.32 2o5j s GLU 436 Cb -0.10 -1.61 0.11 0.00 -4.31 0.00 0.00 34.13 28.22 2o5j s GLU 436 CO 0.02 -0.90 1.37 0.08 0.01 0.00 0.00 175.26 175.84 2o5j s VAL 437 N 1.95 4.52 -0.35 2.63 1.01 -1.26 -2.94 120.40 125.95 2o5j s VAL 437 Ca 0.07 -1.70 -0.29 0.00 0.00 0.00 0.00 61.98 60.05 2o5j s VAL 437 Cb -0.16 -4.94 0.01 0.00 0.00 0.00 0.00 36.38 31.29 2o5j s VAL 437 CO -0.25 -1.72 1.19 -1.81 0.00 0.00 0.00 175.10 172.51 2o5j s ASP 438 N 3.84 6.75 -0.15 3.32 1.01 -1.00 -4.87 116.67 125.57 2o5j s ASP 438 Ca 0.42 0.98 0.17 0.00 0.71 0.00 0.00 52.55 54.83 2o5j s ASP 438 Cb -0.02 -2.54 0.76 0.00 1.01 0.00 0.00 42.92 42.13 2o5j s ASP 438 CO -0.05 -1.06 1.67 0.00 0.21 0.00 0.00 175.17 175.95 2o5j n LEU 439 N 7.44 5.07 -0.01 1.23 -0.00 -1.26 -1.59 117.00 127.88 2o5j n LEU 439 Ca 0.13 -2.56 0.04 0.00 -0.00 0.00 0.00 56.01 53.62 2o5j n LEU 439 Cb 0.47 -0.61 -0.13 0.00 -0.00 0.00 0.00 43.42 43.15 2o5j n LEU 439 CO 0.64 0.77 -0.66 0.52 -0.00 0.00 0.00 177.39 178.65 2o5j n VAL 440 N 1.02 0.60 -0.30 1.47 0.31 -1.26 -4.28 118.33 115.90 2o5j n VAL 440 Ca 0.27 -0.62 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2o5j n VAL 440 Cb 0.98 -0.28 0.00 0.00 -0.91 0.00 0.00 33.84 33.64 2o5j n VAL 440 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2o5j n ARG 441 N -2.53 2.11 -3.87 5.55 3.00 -1.26 -5.02 116.66 114.64 2o5j n ARG 441 Ca -0.11 -1.21 -0.24 0.00 -0.01 0.00 0.00 57.85 56.28 2o5j n ARG 441 Cb 0.75 -0.85 -0.00 0.00 0.00 0.00 0.00 32.46 32.35 2o5j n ARG 441 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 2o5j n ASN 442 N -0.36 -0.64 -4.01 0.55 3.02 -1.19 -4.98 115.26 107.66 2o5j n ASN 442 Ca 0.00 -0.94 -0.08 0.00 -0.03 0.00 0.00 54.58 53.53 2o5j n ASN 442 Cb 0.33 -3.40 -0.09 0.00 -0.61 0.00 0.00 39.78 36.00 2o5j n ASN 442 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2o5j s VAL 443 N -3.85 0.18 -0.27 2.41 0.11 -0.62 -3.37 120.40 114.99 2o5j s VAL 443 Ca 0.01 -1.59 0.02 0.00 -2.93 0.00 0.00 61.98 57.49 2o5j s VAL 443 Cb -0.01 -1.51 0.07 0.00 -1.53 0.00 0.00 36.38 33.41 2o5j s VAL 443 CO 0.86 -0.82 -0.04 -0.69 -3.33 0.00 0.00 175.10 171.08 2o5j s VAL 444 N -3.91 1.79 0.15 2.04 1.01 -0.87 -2.38 120.40 118.23 2o5j s VAL 444 Ca 0.08 -1.56 -0.09 0.00 0.00 0.00 0.00 61.98 60.41 2o5j s VAL 444 Cb 0.07 -2.08 -0.06 0.00 0.00 0.00 0.00 36.38 34.30 2o5j s VAL 444 CO -0.09 -0.22 0.47 0.00 0.00 0.00 0.00 175.10 175.26 2o5j s ARG 445 N 1.24 3.78 -0.30 2.72 1.70 -1.15 -2.09 118.95 124.85 2o5j s ARG 445 Ca -0.02 0.20 -0.01 0.00 -0.47 0.00 0.00 55.73 55.42 2o5j s ARG 445 Cb -0.19 -2.84 0.10 0.00 -0.57 0.00 0.00 34.95 31.45 2o5j s ARG 445 CO -0.08 0.44 0.10 0.08 -1.08 0.00 0.00 175.30 174.77 2o5j s VAL 446 N -1.61 0.71 0.03 4.99 1.01 -1.24 -2.24 120.40 122.06 2o5j s VAL 446 Ca 0.40 -1.25 -0.00 0.00 0.00 0.00 0.00 61.98 61.13 2o5j s VAL 446 Cb -0.13 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.74 2o5j s VAL 446 CO 0.21 -0.65 0.01 1.33 0.00 0.00 0.00 175.10 176.00 2o5j n VAL 447 N 4.92 0.00 -4.30 2.92 0.24 0.04 -3.19 118.33 118.97 2o5j n VAL 447 Ca -0.03 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 62.09 2o5j n VAL 447 Cb 0.42 -0.02 -0.15 0.00 -1.47 0.00 0.00 33.84 32.63 2o5j n VAL 447 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2o5j s GLU 448 N -1.66 0.63 -0.27 7.34 2.12 -1.14 -3.99 118.70 121.73 2o5j s GLU 448 Ca 0.01 -0.27 -0.17 0.00 0.36 0.00 0.00 54.97 54.90 2o5j s GLU 448 Cb -0.00 -0.61 0.08 0.00 0.26 0.00 0.00 34.13 33.85 2o5j s GLU 448 CO 0.01 0.16 0.67 0.45 -0.54 0.00 0.00 175.26 176.01 2o5j s SER 449 N -0.15 -0.89 -0.22 -1.70 0.15 -1.24 -4.06 113.70 105.58 2o5j s SER 449 Ca 0.03 1.46 -0.02 0.00 0.70 0.00 0.00 55.95 58.12 2o5j s SER 449 Cb -0.03 1.35 0.07 0.00 -1.71 0.00 0.00 66.02 65.70 2o5j s SER 449 CO -0.00 -0.24 0.03 -0.47 1.20 0.00 0.00 173.24 173.76 2o5j s TYR 450 N 1.45 1.43 0.29 3.44 5.04 -1.26 -4.75 117.35 122.99 2o5j s TYR 450 Ca -0.09 -1.20 -0.29 0.00 -2.44 0.00 0.00 57.07 53.06 2o5j s TYR 450 Cb -0.05 -1.26 -0.13 0.00 0.35 0.00 0.00 41.96 40.87 2o5j s TYR 450 CO -0.17 -0.69 1.23 -0.25 -1.34 0.00 0.00 175.55 174.34 2o5j n ASP 451 N 4.94 2.27 -3.83 4.32 8.00 -1.26 -4.64 116.55 126.35 2o5j n ASP 451 Ca -0.08 1.18 -0.29 0.00 0.71 0.00 0.00 54.79 56.31 2o5j n ASP 451 Cb 0.46 -1.40 -0.16 0.00 -0.02 0.00 0.00 41.12 40.00 2o5j n ASP 451 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2o5j s ILE 452 N -0.76 0.99 -0.58 0.53 2.07 -1.26 -3.74 121.20 118.45 2o5j s ILE 452 Ca 0.61 -0.83 -0.28 0.00 -1.41 0.00 0.00 60.65 58.74 2o5j s ILE 452 Cb -0.64 -1.37 0.01 0.00 0.13 0.00 0.00 42.46 40.60 2o5j s ILE 452 CO 0.58 -0.13 1.41 -1.81 -1.91 0.00 0.00 174.94 173.07 2o5j s ASP 453 N 1.65 6.12 -0.16 4.50 1.01 -1.14 -4.95 116.67 123.70 2o5j s ASP 453 Ca -0.03 0.22 0.01 0.00 0.71 0.00 0.00 52.55 53.46 2o5j s ASP 453 Cb -0.18 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.21 2o5j s ASP 453 CO -0.07 -1.73 -0.17 0.00 0.21 0.00 0.00 175.17 173.41 2o5j s ALA 454 N 6.07 2.44 -0.08 5.23 0.00 -1.26 -2.08 121.76 132.07 2o5j s ALA 454 Ca 0.51 -1.08 0.03 0.00 0.00 0.00 0.00 51.96 51.41 2o5j s ALA 454 Cb -0.10 -1.19 0.01 0.00 0.00 0.00 0.00 23.12 21.84 2o5j s ALA 454 CO 0.24 -0.08 -0.15 1.03 0.00 0.00 0.00 175.76 176.80 2o5j s ARG 455 N 0.89 2.08 -0.28 0.00 0.52 -1.19 -4.97 118.95 116.00 2o5j s ARG 455 Ca -0.04 -0.54 -0.06 0.00 -0.52 0.00 0.00 55.73 54.57 2o5j s ARG 455 Cb -0.15 -1.68 0.00 0.00 0.52 0.00 0.00 34.95 33.64 2o5j s ARG 455 CO -0.02 0.05 0.06 0.00 0.02 0.00 0.00 175.30 175.41 2o5j s MET 456 N 0.64 3.19 0.00 3.54 0.23 -0.33 -3.52 119.30 123.06 2o5j s MET 456 Ca -0.14 -0.78 0.00 0.00 -1.03 0.00 0.00 55.69 53.73 2o5j s MET 456 Cb -0.16 -3.32 0.00 0.00 -1.53 0.00 0.00 34.83 29.82 2o5j s MET 456 CO 0.04 -0.38 0.00 0.41 -2.03 0.00 0.00 175.02 173.06 2o5j n GLY 457 N 4.86 -1.08 0.34 3.16 0.00 0.29 -4.38 105.19 108.39 2o5j n GLY 457 Ca -0.15 -2.14 0.19 0.00 0.00 0.00 0.00 46.02 43.92 2o5j n GLY 457 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j h ALA 458 N 0.00 1.30 -0.30 4.61 0.00 -1.76 0.74 119.26 123.85 2o5j h ALA 458 Ca 0.00 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2o5j h ALA 458 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 2o5j h ALA 458 CO 0.00 -0.21 -0.20 1.49 0.00 0.00 0.00 179.25 180.33 2o5j h GLU 459 N 0.00 -0.16 0.20 0.00 4.81 -1.78 0.14 114.58 117.78 2o5j h GLU 459 Ca 0.02 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.27 2o5j h GLU 459 Cb 0.40 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 2o5j h GLU 459 CO -0.00 -0.11 -0.34 0.00 -0.73 0.00 0.00 179.01 177.83 2o5j h ALA 460 N 1.00 -0.63 0.00 2.92 0.00 -1.02 -2.75 119.26 118.78 2o5j h ALA 460 Ca 0.16 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 2o5j h ALA 460 Cb 0.41 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 2o5j h ALA 460 CO -0.41 -0.91 -0.53 0.82 0.00 0.00 0.00 179.25 178.23 2o5j h ILE 461 N -0.62 1.06 -0.88 0.00 1.08 -1.59 -2.47 117.51 114.10 2o5j h ILE 461 Ca 0.01 -2.06 0.04 0.00 -0.39 0.00 0.00 64.86 62.47 2o5j h ILE 461 Cb 0.61 2.22 -0.06 0.00 -3.07 0.00 0.00 36.82 36.53 2o5j h ILE 461 CO -0.15 0.52 0.56 -0.61 -0.69 0.00 0.00 178.15 177.78 2o5j h GLN 462 N 0.00 1.04 0.41 2.37 4.15 -0.44 0.51 115.11 123.14 2o5j h GLN 462 Ca -0.01 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.33 2o5j h GLN 462 Cb 1.18 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.64 2o5j h GLN 462 CO 0.07 0.69 -0.20 1.96 -1.93 0.00 0.00 178.83 179.42 2o5j h GLN 463 N 1.07 -0.53 -0.92 1.69 1.08 -1.30 -2.87 115.11 113.34 2o5j h GLN 463 Ca 0.36 0.04 0.21 0.00 -1.45 0.00 0.00 58.65 57.81 2o5j h GLN 463 Cb 0.06 0.12 -0.07 0.00 -0.05 0.00 0.00 27.48 27.54 2o5j h GLN 463 CO -0.13 -0.24 0.61 -0.07 -0.95 0.00 0.00 178.83 178.04 2o5j h LEU 464 N -1.03 0.41 -0.77 1.46 3.38 -1.33 0.47 115.31 117.91 2o5j h LEU 464 Ca -0.06 0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2o5j h LEU 464 Cb 0.53 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2o5j h LEU 464 CO 0.09 0.16 -0.45 0.25 0.09 0.00 0.00 178.44 178.58 2o5j h LEU 465 N 0.41 0.41 -0.11 1.67 6.46 -0.91 -3.13 115.31 120.11 2o5j h LEU 465 Ca 0.48 -0.19 -0.21 0.00 -0.12 0.00 0.00 57.88 57.84 2o5j h LEU 465 Cb 1.20 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 41.00 2o5j h LEU 465 CO -0.19 0.80 -0.99 0.11 -0.62 0.00 0.00 178.44 177.56 2o5j h LYS 466 N 0.31 0.12 0.00 1.25 1.57 -0.70 -3.27 116.57 115.85 2o5j h LYS 466 Ca 0.02 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2o5j h LYS 466 Cb 0.92 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.28 2o5j h LYS 466 CO 0.08 1.01 0.00 0.39 -0.57 0.00 0.00 179.45 180.36 2o5j n GLU 467 N -3.52 0.88 -3.59 3.15 1.02 -0.79 -4.82 120.64 112.97 2o5j n GLU 467 Ca -0.03 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.74 2o5j n GLU 467 Cb 0.90 -1.45 -0.09 0.00 -0.02 0.00 0.00 31.44 30.77 2o5j n GLU 467 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2o5j s LEU 468 N -1.90 4.11 -0.97 -4.62 1.43 -1.22 -5.00 118.68 110.50 2o5j s LEU 468 Ca 0.38 0.18 -0.15 0.00 -1.03 0.00 0.00 54.13 53.52 2o5j s LEU 468 Cb 0.17 -2.20 0.19 0.00 0.03 0.00 0.00 46.19 44.39 2o5j s LEU 468 CO 0.29 0.02 1.06 -0.62 0.23 0.00 0.00 176.35 177.33 2o5j s ASP 469 N 1.14 6.87 0.20 2.29 -1.08 -1.26 -4.91 116.67 119.92 2o5j s ASP 469 Ca 0.10 -2.68 -0.04 0.00 -0.52 0.00 0.00 52.55 49.41 2o5j s ASP 469 Cb -0.14 -2.31 0.37 0.00 -1.46 0.00 0.00 42.92 39.38 2o5j s ASP 469 CO 0.06 -0.72 1.08 0.18 0.52 0.00 0.00 175.17 176.29 2o5j n LEU 470 N 4.89 -0.21 -0.19 -1.34 4.77 -1.26 0.42 117.00 124.08 2o5j n LEU 470 Ca 0.23 1.18 0.00 0.00 -0.03 0.00 0.00 56.01 57.39 2o5j n LEU 470 Cb 0.46 -0.38 0.09 0.00 -2.33 0.00 0.00 43.42 41.26 2o5j n LEU 470 CO 0.46 -1.15 0.84 -0.33 -1.33 0.00 0.00 177.39 175.88 2o5j h GLU 471 N 0.00 0.12 -0.28 3.23 4.39 -1.96 0.53 114.58 120.60 2o5j h GLU 471 Ca 0.35 -0.01 0.01 0.00 0.34 0.00 0.00 59.36 60.05 2o5j h GLU 471 Cb 0.59 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.20 2o5j h GLU 471 CO -0.70 0.08 0.17 0.00 -1.16 0.00 0.00 179.01 177.40 2o5j h ALA 472 N 1.53 0.35 0.00 3.43 0.00 -0.46 -0.89 119.26 123.23 2o5j h ALA 472 Ca 0.31 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 2o5j h ALA 472 Cb 0.49 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2o5j h ALA 472 CO -0.50 -0.20 -0.22 -0.07 0.00 0.00 0.00 179.25 178.26 2o5j h LEU 473 N 0.35 0.00 0.90 0.00 4.07 -1.13 -1.71 115.31 117.80 2o5j h LEU 473 Ca 0.10 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.02 2o5j h LEU 473 Cb -0.02 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.72 2o5j h LEU 473 CO -0.04 0.22 -0.43 -0.08 -1.08 0.00 0.00 178.44 177.03 2o5j h GLU 474 N 0.00 -1.17 0.18 1.13 4.81 0.13 -0.58 114.58 119.09 2o5j h GLU 474 Ca -0.00 0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2o5j h GLU 474 Cb 0.78 0.26 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 2o5j h GLU 474 CO 0.03 -0.77 -0.46 0.87 -0.73 0.00 0.00 179.01 177.95 2o5j h LYS 475 N -1.25 -0.71 -0.88 1.92 1.57 -1.17 -0.26 116.57 115.79 2o5j h LYS 475 Ca -0.12 0.05 0.20 0.00 -1.87 0.00 0.00 60.65 58.90 2o5j h LYS 475 Cb 0.93 0.16 -0.16 0.00 0.08 0.00 0.00 32.23 33.24 2o5j h LYS 475 CO 0.20 -0.47 -0.10 1.49 -0.57 0.00 0.00 179.45 180.00 2o5j h GLU 476 N -0.73 0.03 -0.26 3.15 4.81 -1.33 0.50 114.58 120.75 2o5j h GLU 476 Ca 0.00 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 2o5j h GLU 476 Cb 0.73 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2o5j h GLU 476 CO -0.23 0.02 0.09 -0.07 -0.73 0.00 0.00 179.01 178.09 2o5j h LEU 477 N 0.03 0.36 -0.67 1.64 3.38 -0.65 -0.57 115.31 118.83 2o5j h LEU 477 Ca 0.47 -0.18 0.13 0.00 0.09 0.00 0.00 57.88 58.39 2o5j h LEU 477 Cb 0.81 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.34 2o5j h LEU 477 CO -0.86 0.45 -0.18 -0.07 0.09 0.00 0.00 178.44 177.87 2o5j h LEU 478 N 0.26 -0.68 0.10 1.67 3.38 0.18 0.71 115.31 120.93 2o5j h LEU 478 Ca 0.08 0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 2o5j h LEU 478 Cb 0.21 0.43 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2o5j h LEU 478 CO -0.01 -0.23 -0.05 -0.33 0.09 0.00 0.00 178.44 177.92 2o5j h GLU 479 N -0.02 -0.13 -0.30 1.13 5.08 -1.19 -2.90 114.58 116.26 2o5j h GLU 479 Ca 0.32 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.76 2o5j h GLU 479 Cb 0.50 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2o5j h GLU 479 CO -0.70 0.15 0.21 1.49 -1.00 0.00 0.00 179.01 179.17 2o5j h GLU 480 N -0.40 0.09 0.23 2.33 4.57 0.38 -2.59 114.58 119.19 2o5j h GLU 480 Ca -0.01 -0.01 -0.33 0.00 -1.18 0.00 0.00 59.36 57.83 2o5j h GLU 480 Cb 0.34 -0.02 0.04 0.00 -0.16 0.00 0.00 28.75 28.94 2o5j h GLU 480 CO 0.02 0.06 -1.43 1.98 -1.18 0.00 0.00 179.01 178.46 2o5j h MET 481 N 0.09 0.56 -0.00 1.92 4.05 0.56 -3.33 114.93 118.78 2o5j h MET 481 Ca 0.14 -0.91 0.00 0.00 -0.28 0.00 0.00 59.70 58.65 2o5j h MET 481 Cb 0.44 0.33 0.00 0.00 -0.80 0.00 0.00 31.60 31.57 2o5j h MET 481 CO -0.01 1.43 -0.64 1.63 0.23 0.00 0.00 176.91 179.55 2o5j n LYS 482 N -3.74 0.10 -0.03 0.39 5.02 -1.13 -4.71 118.16 114.06 2o5j n LYS 482 Ca -0.16 -0.07 -0.03 0.00 -2.02 0.00 0.00 58.31 56.03 2o5j n LYS 482 Cb 1.08 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.58 2o5j n LYS 482 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2o5j n HIS 483 N -1.39 0.00 -0.21 2.13 8.25 -0.98 -5.02 115.22 117.99 2o5j n HIS 483 Ca 0.06 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.31 2o5j n HIS 483 Cb 0.34 -0.16 0.20 0.00 1.12 0.00 0.00 29.99 31.49 2o5j n HIS 483 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2o5j n PRO 484 N -3.12 -3.50 -1.10 -0.41 -0.02 -1.25 -4.99 135.00 120.62 2o5j n PRO 484 Ca -0.04 -0.98 -0.29 0.00 -2.02 0.00 0.00 63.50 60.16 2o5j n PRO 484 Cb 0.16 -1.37 0.21 0.00 -0.02 0.00 0.00 33.50 32.48 2o5j n PRO 484 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2o5j s SER 485 N -2.62 1.79 0.53 2.55 0.01 -1.26 -4.81 113.70 109.89 2o5j s SER 485 Ca 0.45 0.96 0.27 0.00 1.31 0.00 0.00 55.95 58.94 2o5j s SER 485 Cb -0.08 -1.46 1.46 0.00 0.21 0.00 0.00 66.02 66.15 2o5j s SER 485 CO 0.38 -3.62 2.08 0.03 0.41 0.00 0.00 173.24 172.51 2o5j h ARG 486 N -2.23 0.00 0.78 12.44 3.08 -1.96 -3.00 114.38 123.50 2o5j h ARG 486 Ca -0.51 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.50 2o5j h ARG 486 Cb 1.32 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.38 2o5j h ARG 486 CO 0.48 0.11 -0.39 0.00 -1.07 0.00 0.00 179.97 179.10 2o5j h ALA 487 N 1.89 -1.28 0.00 0.04 0.00 -2.00 -1.34 119.26 116.57 2o5j h ALA 487 Ca -0.00 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 2o5j h ALA 487 Cb 0.32 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2o5j h ALA 487 CO 0.01 -1.21 -0.53 0.07 0.00 0.00 0.00 179.25 177.59 2o5j h ARG 488 N -1.07 0.00 -0.17 0.00 0.11 -1.95 -3.28 114.38 108.02 2o5j h ARG 488 Ca -0.11 0.00 -0.16 0.00 0.10 0.00 0.00 59.98 59.81 2o5j h ARG 488 Cb 0.83 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.90 2o5j h ARG 488 CO 0.17 0.21 -0.56 0.07 0.10 0.00 0.00 179.97 179.96 2o5j h ARG 489 N 0.00 0.52 0.03 0.08 0.11 -1.57 -2.46 114.38 111.09 2o5j h ARG 489 Ca -0.02 -0.33 -0.00 0.00 0.10 0.00 0.00 59.98 59.72 2o5j h ARG 489 Cb 1.21 0.04 0.00 0.00 1.11 0.00 0.00 29.97 32.33 2o5j h ARG 489 CO 0.03 0.94 -0.02 0.00 0.10 0.00 0.00 179.97 181.02 2o5j h ALA 490 N 0.99 -0.05 -0.86 0.08 0.00 -1.30 -1.47 119.26 116.66 2o5j h ALA 490 Ca 0.01 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 54.98 2o5j h ALA 490 Cb 1.10 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.84 2o5j h ALA 490 CO 0.10 -0.49 0.56 -0.22 0.00 0.00 0.00 179.25 179.20 2o5j h LYS 491 N -0.12 0.73 0.00 0.00 1.63 -1.60 0.95 116.57 118.15 2o5j h LYS 491 Ca -0.00 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.72 2o5j h LYS 491 Cb 0.11 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 31.57 2o5j h LYS 491 CO 0.01 0.49 -0.16 0.00 -3.45 0.00 0.00 179.45 176.34 2o5j h ALA 492 N 1.59 0.95 0.10 5.00 0.00 -1.10 -2.76 119.26 123.04 2o5j h ALA 492 Ca 0.41 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2o5j h ALA 492 Cb 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2o5j h ALA 492 CO -0.18 0.20 -0.05 0.07 0.00 0.00 0.00 179.25 179.29 2o5j h ARG 493 N 0.00 -0.12 -0.47 0.00 -0.00 0.26 -1.42 114.38 112.63 2o5j h ARG 493 Ca -0.00 0.01 0.01 0.00 -0.00 0.00 0.00 59.98 60.00 2o5j h ARG 493 Cb 0.86 0.03 -0.02 0.00 -0.00 0.00 0.00 29.97 30.83 2o5j h ARG 493 CO 0.02 0.30 0.31 -0.22 -0.00 0.00 0.00 179.97 180.38 2o5j h LYS 494 N -0.59 0.59 0.00 0.08 3.64 -1.53 -1.18 116.57 117.57 2o5j h LYS 494 Ca -0.01 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2o5j h LYS 494 Cb 0.48 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2o5j h LYS 494 CO 0.02 0.39 0.00 -0.09 -2.27 0.00 0.00 179.45 177.50 2o5j h ARG 495 N 0.60 0.00 0.04 1.90 2.43 -1.44 -3.24 114.38 114.68 2o5j h ARG 495 Ca 0.18 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 59.10 2o5j h ARG 495 Cb -0.03 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 2o5j h ARG 495 CO -0.04 0.00 -1.20 1.25 -1.51 0.00 0.00 179.97 178.47 2o5j h LEU 496 N 0.00 0.15 -0.35 3.80 5.85 -0.07 -3.31 115.31 121.38 2o5j h LEU 496 Ca 0.00 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.48 2o5j h LEU 496 Cb 0.79 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2o5j h LEU 496 CO 0.00 1.14 -0.03 -0.33 -0.34 0.00 0.00 178.44 178.88 2o5j h GLU 497 N 0.03 0.64 0.21 1.25 5.08 -1.56 0.06 114.58 120.29 2o5j h GLU 497 Ca -0.10 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2o5j h GLU 497 Cb 1.88 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 31.04 2o5j h GLU 497 CO 0.15 0.78 -0.49 0.28 -1.00 0.00 0.00 179.01 178.72 2o5j h VAL 498 N 0.45 0.00 -0.69 3.13 2.07 -1.69 0.21 116.25 119.72 2o5j h VAL 498 Ca 0.10 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.74 2o5j h VAL 498 Cb 0.51 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.19 2o5j h VAL 498 CO 0.02 0.00 0.24 0.58 0.02 0.00 0.00 177.57 178.43 2o5j h VAL 499 N -0.77 0.67 0.16 2.57 2.07 -1.63 -2.44 116.25 116.88 2o5j h VAL 499 Ca -0.02 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2o5j h VAL 499 Cb 0.74 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2o5j h VAL 499 CO -0.21 0.07 -0.32 0.03 0.02 0.00 0.00 177.57 177.16 2o5j h ARG 500 N 0.39 -0.50 -0.91 1.57 2.47 -0.01 -2.80 114.38 114.59 2o5j h ARG 500 Ca 0.37 0.03 0.26 0.00 -1.26 0.00 0.00 59.98 59.38 2o5j h ARG 500 Cb 0.54 0.11 -0.16 0.00 -1.65 0.00 0.00 29.97 28.82 2o5j h ARG 500 CO -0.39 -0.33 0.19 0.00 0.56 0.00 0.00 179.97 180.00 2o5j h ALA 501 N -1.05 1.29 0.67 0.04 0.00 -0.18 0.65 119.26 120.70 2o5j h ALA 501 Ca -0.02 0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 2o5j h ALA 501 Cb 0.49 0.41 0.01 0.00 0.00 0.00 0.00 17.79 18.69 2o5j h ALA 501 CO -0.13 -0.54 -0.32 0.74 0.00 0.00 0.00 179.25 179.00 2o5j h PHE 502 N 0.13 -0.84 -0.33 0.00 -1.00 -1.21 -2.10 116.94 111.59 2o5j h PHE 502 Ca 0.58 -0.02 0.06 0.00 2.81 0.00 0.00 57.97 61.40 2o5j h PHE 502 Cb 1.22 0.28 -0.05 0.00 3.61 0.00 0.00 35.95 41.01 2o5j h PHE 502 CO -0.32 -0.52 -0.02 -0.07 -1.61 0.00 0.00 178.31 175.77 2o5j h LEU 503 N -0.92 -0.17 0.13 1.54 3.38 -1.17 -0.96 115.31 117.15 2o5j h LEU 503 Ca -0.09 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2o5j h LEU 503 Cb 0.69 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2o5j h LEU 503 CO 0.15 -0.05 -0.30 -0.78 0.09 0.00 0.00 178.44 177.56 2o5j h ASP 504 N 0.07 -0.88 0.50 -0.43 -0.00 -0.88 -2.93 116.42 111.87 2o5j h ASP 504 Ca 0.16 0.09 -0.10 0.00 -0.00 0.00 0.00 57.03 57.18 2o5j h ASP 504 Cb 0.22 0.31 -0.01 0.00 -0.00 0.00 0.00 39.33 39.86 2o5j h ASP 504 CO -0.28 -0.33 -0.46 0.28 -0.00 0.00 0.00 179.24 178.44 2o5j h SER 505 N -0.47 0.00 0.00 2.28 0.02 -1.41 -3.49 113.55 110.48 2o5j h SER 505 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2o5j h SER 505 Cb 0.45 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.99 2o5j h SER 505 CO -0.13 0.46 0.00 0.61 -1.14 0.00 0.00 176.83 176.63 2o5j n GLY 506 N -0.15 1.77 0.00 -3.77 0.00 -0.37 -4.78 105.19 97.89 2o5j n GLY 506 Ca -0.01 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2o5j n GLY 506 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2o5j n ASN 507 N 0.00 0.00 -4.80 1.61 3.02 -1.26 -4.29 115.26 109.55 2o5j n ASN 507 Ca 0.00 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.21 2o5j n ASN 507 Cb 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 2o5j n ASN 507 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2o5j s ARG 508 N 0.00 3.50 0.00 3.52 1.81 -1.26 -4.77 118.95 121.76 2o5j s ARG 508 Ca 0.00 1.33 0.20 0.00 -1.72 0.00 0.00 55.73 55.53 2o5j s ARG 508 Cb 0.00 -2.05 1.17 0.00 -0.45 0.00 0.00 34.95 33.62 2o5j s ARG 508 CO 0.00 -0.68 1.56 -0.35 -0.68 0.00 0.00 175.30 175.16 2o5j n PRO 509 N -1.51 0.63 0.00 3.54 -0.04 -1.26 -3.83 135.00 132.53 2o5j n PRO 509 Ca 0.09 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.66 2o5j n PRO 509 Cb 0.52 -1.48 0.45 0.00 -0.04 0.00 0.00 33.50 32.95 2o5j n PRO 509 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2o5j n GLU 510 N -0.98 0.01 0.00 0.54 1.02 -1.26 -2.97 120.64 117.00 2o5j n GLU 510 Ca 0.15 0.15 0.15 0.00 -0.02 0.00 0.00 57.16 57.58 2o5j n GLU 510 Cb 0.07 -1.51 0.73 0.00 -0.02 0.00 0.00 31.44 30.71 2o5j n GLU 510 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 2o5j n TRP 511 N -1.53 0.00 0.29 -0.32 5.03 -1.25 -3.76 117.44 115.90 2o5j n TRP 511 Ca 0.05 0.00 0.15 0.00 3.03 0.00 0.00 57.50 60.73 2o5j n TRP 511 Cb 0.25 -0.08 0.88 0.00 -1.03 0.00 0.00 31.31 31.33 2o5j n TRP 511 CO 0.00 0.00 0.00 0.52 -0.03 0.00 0.00 177.69 178.18 2o5j h MET 512 N 0.69 0.00 -6.11 -0.99 2.86 -1.85 -3.40 114.93 106.13 2o5j h MET 512 Ca 0.00 0.00 -0.59 0.00 -2.06 0.00 0.00 59.70 57.05 2o5j h MET 512 Cb 0.25 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.86 2o5j h MET 512 CO 0.00 0.05 -0.12 0.42 1.06 0.00 0.00 176.91 178.32 2o5j s ILE 513 N -4.33 4.89 -0.26 -1.22 1.01 -1.25 -2.96 121.20 117.09 2o5j s ILE 513 Ca -0.04 1.03 -0.09 0.00 0.00 0.00 0.00 60.65 61.55 2o5j s ILE 513 Cb 0.14 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 2o5j s ILE 513 CO 0.54 0.55 0.13 -0.76 0.00 0.00 0.00 174.94 175.41 2o5j s LEU 514 N -1.00 3.82 0.00 2.97 1.43 1.16 -4.86 118.68 122.21 2o5j s LEU 514 Ca 0.26 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.31 2o5j s LEU 514 Cb -0.18 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.00 2o5j s LEU 514 CO 0.16 -0.01 0.05 -1.84 0.23 0.00 0.00 176.35 174.94 2o5j n GLU 515 N 4.77 5.23 -3.74 1.70 0.28 -1.26 0.30 120.64 127.92 2o5j n GLU 515 Ca -0.15 -0.05 -0.26 0.00 -0.16 0.00 0.00 57.16 56.55 2o5j n GLU 515 Cb 0.52 -0.48 -0.17 0.00 1.43 0.00 0.00 31.44 32.73 2o5j n GLU 515 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2o5j s ALA 516 N -0.76 0.82 -0.41 -1.84 0.00 -1.26 -2.04 121.76 116.26 2o5j s ALA 516 Ca 0.00 -0.42 -0.16 0.00 0.00 0.00 0.00 51.96 51.37 2o5j s ALA 516 Cb 0.00 -0.99 0.02 0.00 0.00 0.00 0.00 23.12 22.15 2o5j s ALA 516 CO 0.00 -0.89 0.38 0.08 0.00 0.00 0.00 175.76 175.33 2o5j s VAL 517 N 1.94 5.16 0.19 0.00 1.01 -0.72 -4.96 120.40 123.01 2o5j s VAL 517 Ca 0.02 -0.42 -0.31 0.00 0.00 0.00 0.00 61.98 61.27 2o5j s VAL 517 Cb -0.15 -3.97 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 2o5j s VAL 517 CO -0.07 -0.34 1.42 -2.84 0.00 0.00 0.00 175.10 173.27 2o5j s PRO 518 N 1.95 4.30 -0.11 2.72 0.02 -1.26 -2.29 135.00 140.34 2o5j s PRO 518 Ca 0.09 2.19 -0.14 0.00 0.02 0.00 0.00 61.00 63.17 2o5j s PRO 518 Cb -0.18 -3.17 -0.05 0.00 0.02 0.00 0.00 34.50 31.12 2o5j s PRO 518 CO 0.12 -0.42 0.33 0.08 -0.33 0.00 0.00 177.00 176.78 2o5j s VAL 519 N 0.52 5.24 0.56 3.83 1.01 -1.11 -4.94 120.40 125.50 2o5j s VAL 519 Ca 0.62 0.64 -0.18 0.00 0.00 0.00 0.00 61.98 63.05 2o5j s VAL 519 Cb -0.40 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.29 2o5j s VAL 519 CO 0.36 0.46 1.11 -0.22 0.00 0.00 0.00 175.10 176.81 2o5j s LEU 520 N -0.08 3.67 0.81 3.92 2.96 -1.26 -3.56 118.68 125.14 2o5j s LEU 520 Ca 0.19 2.07 -0.15 0.00 -0.22 0.00 0.00 54.13 56.03 2o5j s LEU 520 Cb -0.14 -4.57 0.01 0.00 0.50 0.00 0.00 46.19 41.99 2o5j s LEU 520 CO 0.07 -1.23 0.64 -0.81 -1.32 0.00 0.00 176.35 173.70 2o5j n PRO 521 N -1.54 0.11 -0.00 0.98 -0.04 -1.26 -4.78 135.00 128.46 2o5j n PRO 521 Ca 0.11 0.09 -0.12 0.00 -0.04 0.00 0.00 63.50 63.54 2o5j n PRO 521 Cb 0.52 -1.97 -0.09 0.00 -0.04 0.00 0.00 33.50 31.91 2o5j n PRO 521 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2o5j h PRO 522 N -0.83 -0.08 -0.81 0.54 0.13 -1.83 -3.28 132.00 125.84 2o5j h PRO 522 Ca -0.45 0.01 0.19 0.00 -0.87 0.00 0.00 66.00 64.88 2o5j h PRO 522 Cb 1.32 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.42 2o5j h PRO 522 CO 0.41 0.50 0.55 -0.44 -0.23 0.00 0.00 178.00 178.78 2o5j h ASP 523 N -0.80 0.25 -0.00 1.44 3.32 -1.89 -2.46 116.42 116.29 2o5j h ASP 523 Ca -0.01 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2o5j h ASP 523 Cb 0.62 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.14 2o5j h ASP 523 CO 0.01 0.11 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.57 2o5j h LEU 524 N 0.26 -0.02 -7.18 1.55 4.07 -1.84 -3.21 115.31 108.94 2o5j h LEU 524 Ca 0.40 0.00 -0.79 0.00 0.08 0.00 0.00 57.88 57.58 2o5j h LEU 524 Cb 1.19 0.01 -0.25 0.00 1.08 0.00 0.00 40.66 42.69 2o5j h LEU 524 CO -0.10 -0.01 0.95 -2.11 -1.08 0.00 0.00 178.44 176.09 2o5j n ARG 525 N -5.10 3.88 -1.09 1.13 0.00 -0.92 -4.99 116.66 109.57 2o5j n ARG 525 Ca -0.07 -4.26 -0.43 0.00 -0.00 0.00 0.00 57.85 53.09 2o5j n ARG 525 Cb 0.04 -2.67 -0.06 0.00 -0.00 0.00 0.00 32.46 29.78 2o5j n ARG 525 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2o5j n PRO 526 N 2.80 0.00 -3.75 2.89 -0.02 -1.22 -3.96 135.00 131.74 2o5j n PRO 526 Ca 0.29 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.43 2o5j n PRO 526 Cb 0.37 -1.08 -0.10 0.00 -0.02 0.00 0.00 33.50 32.67 2o5j n PRO 526 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2o5j s MET 527 N 0.07 2.69 0.12 -0.52 1.75 -1.25 -2.39 119.30 119.77 2o5j s MET 527 Ca 0.66 -2.90 0.07 0.00 -1.25 0.00 0.00 55.69 52.26 2o5j s MET 527 Cb -0.92 -3.70 -0.04 0.00 2.84 0.00 0.00 34.83 33.01 2o5j s MET 527 CO 0.42 -1.21 -0.04 0.08 -0.65 0.00 0.00 175.02 173.61 2o5j s VAL 528 N -0.71 3.64 -0.33 10.11 1.01 0.22 -4.95 120.40 129.39 2o5j s VAL 528 Ca 0.21 -1.25 -0.26 0.00 0.00 0.00 0.00 61.98 60.68 2o5j s VAL 528 Cb -0.15 -2.75 0.01 0.00 0.00 0.00 0.00 36.38 33.49 2o5j s VAL 528 CO -0.08 0.04 0.92 -1.58 0.00 0.00 0.00 175.10 174.41 2o5j s GLN 529 N -2.47 3.96 0.00 2.72 -0.44 -1.26 -0.69 119.66 121.48 2o5j s GLN 529 Ca 0.24 0.74 0.00 0.00 -2.50 0.00 0.00 55.36 53.84 2o5j s GLN 529 Cb -0.11 -3.75 0.00 0.00 -1.64 0.00 0.00 33.01 27.51 2o5j s GLN 529 CO 0.16 -0.83 0.00 0.28 0.50 0.00 0.00 175.29 175.40 2o5j n VAL 530 N 5.77 0.00 -3.82 1.34 0.31 0.31 -4.94 118.33 117.30 2o5j n VAL 530 Ca 0.07 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.27 2o5j n VAL 530 Cb 0.48 -0.13 -0.14 0.00 -0.91 0.00 0.00 33.84 33.13 2o5j n VAL 530 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2o5j s ASP 531 N -1.00 -0.01 0.00 4.52 1.01 -1.24 -4.83 116.67 115.12 2o5j s ASP 531 Ca 0.00 0.09 0.00 0.00 0.71 0.00 0.00 52.55 53.35 2o5j s ASP 531 Cb 0.00 0.04 0.00 0.00 1.01 0.00 0.00 42.92 43.97 2o5j s ASP 531 CO 0.00 -0.06 0.00 0.61 0.21 0.00 0.00 175.17 175.93 2o5j n GLY 532 N 3.51 1.18 0.00 0.21 0.00 -1.26 -1.66 105.19 107.17 2o5j n GLY 532 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2o5j n GLY 532 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o5j n GLY 533 N -1.81 -0.47 3.76 -0.02 0.00 -1.26 -5.13 105.19 100.26 2o5j n GLY 533 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2o5j n GLY 533 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o5j s ARG 534 N 0.00 4.34 -0.08 1.61 0.52 -0.67 -4.86 118.95 119.81 2o5j s ARG 534 Ca 0.00 2.21 0.03 0.00 -0.52 0.00 0.00 55.73 57.45 2o5j s ARG 534 Cb 0.00 -3.10 0.00 0.00 0.52 0.00 0.00 34.95 32.37 2o5j s ARG 534 CO 0.00 -0.26 -0.20 -0.06 0.02 0.00 0.00 175.30 174.80 2o5j s PHE 535 N -0.59 2.15 -0.15 -0.53 0.40 -1.26 0.11 117.98 118.12 2o5j s PHE 535 Ca 0.53 -0.84 -0.04 0.00 -0.60 0.00 0.00 56.93 55.98 2o5j s PHE 535 Cb -0.40 -1.47 -0.03 0.00 0.51 0.00 0.00 43.02 41.63 2o5j s PHE 535 CO 0.47 -0.35 -0.03 0.00 0.70 0.00 0.00 175.22 176.01 2o5j s ALA 536 N 0.42 3.04 0.03 5.36 0.00 0.14 -4.93 121.76 125.82 2o5j s ALA 536 Ca -0.16 -0.82 0.02 0.00 0.00 0.00 0.00 51.96 51.00 2o5j s ALA 536 Cb -0.17 -1.56 -0.02 0.00 0.00 0.00 0.00 23.12 21.38 2o5j s ALA 536 CO 0.07 0.26 -0.06 -0.08 0.00 0.00 0.00 175.76 175.94 2o5j s THR 537 N 0.22 0.42 0.08 0.00 -1.32 -1.22 -0.61 115.64 113.22 2o5j s THR 537 Ca -0.02 -0.86 -0.31 0.00 -1.21 0.00 0.00 61.69 59.30 2o5j s THR 537 Cb -0.14 -0.48 -0.08 0.00 -1.51 0.00 0.00 72.50 70.29 2o5j s THR 537 CO 0.03 -0.30 1.56 -0.55 -2.21 0.00 0.00 174.62 173.15 2o5j s SER 538 N -1.24 6.67 0.64 8.08 0.15 -1.00 -4.85 113.70 122.14 2o5j s SER 538 Ca -0.08 2.43 0.20 0.00 0.70 0.00 0.00 55.95 59.20 2o5j s SER 538 Cb -0.08 -2.57 1.00 0.00 -1.71 0.00 0.00 66.02 62.66 2o5j s SER 538 CO 0.00 -0.81 1.54 0.44 1.20 0.00 0.00 173.24 175.61 2o5j h ASP 539 N 7.72 0.00 -0.92 5.45 3.45 -1.94 -0.27 116.42 129.91 2o5j h ASP 539 Ca -0.42 0.00 0.21 0.00 0.43 0.00 0.00 57.03 57.26 2o5j h ASP 539 Cb 1.20 0.00 -0.07 0.00 -0.56 0.00 0.00 39.33 39.90 2o5j h ASP 539 CO 0.91 0.00 0.61 -0.07 -1.57 0.00 0.00 179.24 179.12 2o5j h LEU 540 N 0.00 0.40 -0.97 1.55 3.38 -1.89 -0.31 115.31 117.46 2o5j h LEU 540 Ca 0.12 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 2o5j h LEU 540 Cb 1.51 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 42.21 2o5j h LEU 540 CO -0.00 0.15 0.22 0.78 0.09 0.00 0.00 178.44 179.68 2o5j h ASN 541 N 0.39 0.89 -0.54 -0.43 2.35 -1.39 0.12 115.58 116.97 2o5j h ASN 541 Ca 0.48 -0.14 -0.00 0.00 -0.55 0.00 0.00 56.30 56.09 2o5j h ASN 541 Cb 1.23 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 39.34 2o5j h ASN 541 CO -0.18 0.82 0.33 0.44 -1.65 0.00 0.00 177.43 177.19 2o5j h ASP 542 N 0.94 0.65 -0.16 5.81 3.45 -1.24 -1.22 116.42 124.66 2o5j h ASP 542 Ca 0.21 -0.06 -0.02 0.00 0.43 0.00 0.00 57.03 57.60 2o5j h ASP 542 Cb 0.24 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 38.84 2o5j h ASP 542 CO -0.01 0.52 0.02 -0.07 -1.57 0.00 0.00 179.24 178.13 2o5j h LEU 543 N 0.73 0.25 -0.87 1.55 3.38 -1.31 -2.15 115.31 116.89 2o5j h LEU 543 Ca 0.19 -0.27 0.14 0.00 0.09 0.00 0.00 57.88 58.04 2o5j h LEU 543 Cb -0.01 -0.07 -0.09 0.00 0.09 0.00 0.00 40.66 40.58 2o5j h LEU 543 CO -0.04 0.46 0.47 1.88 0.09 0.00 0.00 178.44 181.31 2o5j h TYR 544 N 0.04 0.84 0.20 1.13 -1.99 -0.57 0.77 116.97 117.40 2o5j h TYR 544 Ca 0.05 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.81 2o5j h TYR 544 Cb 0.32 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 38.79 2o5j h TYR 544 CO 0.02 0.23 -0.16 0.00 -0.00 0.00 0.00 178.16 178.26 2o5j h ARG 545 N 0.69 -0.35 -0.66 4.88 3.08 -1.05 0.47 114.38 121.44 2o5j h ARG 545 Ca 0.47 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.61 2o5j h ARG 545 Cb 0.62 0.08 -0.09 0.00 0.08 0.00 0.00 29.97 30.66 2o5j h ARG 545 CO -0.34 -0.24 -0.51 0.00 -1.07 0.00 0.00 179.97 177.81 2o5j h ARG 546 N -0.37 -0.15 -0.19 0.04 3.08 -0.24 0.25 114.38 116.81 2o5j h ARG 546 Ca -0.01 0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.09 2o5j h ARG 546 Cb 0.32 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 2o5j h ARG 546 CO -0.01 -0.10 -0.09 1.25 -1.07 0.00 0.00 179.97 179.96 2o5j h LEU 547 N -0.15 -0.29 -0.07 3.04 5.85 -1.00 -1.79 115.31 120.90 2o5j h LEU 547 Ca 0.11 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.94 2o5j h LEU 547 Cb 0.44 0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.57 2o5j h LEU 547 CO -0.70 -0.11 -0.33 0.40 -0.34 0.00 0.00 178.44 177.35 2o5j h ILE 548 N -0.06 0.27 0.17 4.05 1.08 0.72 -0.92 117.51 122.81 2o5j h ILE 548 Ca 0.10 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.58 2o5j h ILE 548 Cb 0.21 0.27 -0.02 0.00 -3.07 0.00 0.00 36.82 34.22 2o5j h ILE 548 CO -0.23 0.00 -0.17 0.78 -0.69 0.00 0.00 178.15 177.84 2o5j h ASN 549 N -0.45 -0.46 -0.40 1.72 -0.26 -0.40 -1.01 115.58 114.32 2o5j h ASN 549 Ca 0.08 0.05 0.08 0.00 -0.56 0.00 0.00 56.30 55.94 2o5j h ASN 549 Cb 0.56 0.16 -0.07 0.00 -1.06 0.00 0.00 38.32 37.92 2o5j h ASN 549 CO -0.32 -0.26 -0.03 -0.09 -1.06 0.00 0.00 177.43 175.68 2o5j h ARG 550 N -0.37 0.07 -0.83 0.81 9.65 -1.05 0.42 114.38 123.08 2o5j h ARG 550 Ca 0.00 -0.00 0.03 0.00 -1.10 0.00 0.00 59.98 58.91 2o5j h ARG 550 Cb 0.36 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 28.87 2o5j h ARG 550 CO -0.05 0.05 0.53 -0.97 2.80 0.00 0.00 179.97 182.33 2o5j h ASN 551 N 0.08 0.88 0.62 -3.80 -1.24 -0.92 0.37 115.58 111.56 2o5j h ASN 551 Ca 0.20 -0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.17 2o5j h ASN 551 Cb 0.29 -0.20 0.01 0.00 0.73 0.00 0.00 38.32 39.15 2o5j h ASN 551 CO -0.35 0.61 -0.30 0.78 -1.29 0.00 0.00 177.43 176.88 2o5j h ASN 552 N 1.04 -0.70 -0.97 1.15 4.21 -0.32 -1.91 115.58 118.08 2o5j h ASN 552 Ca 0.33 -0.02 0.26 0.00 1.21 0.00 0.00 56.30 58.08 2o5j h ASN 552 Cb 0.01 0.18 -0.06 0.00 -1.12 0.00 0.00 38.32 37.34 2o5j h ASN 552 CO -0.12 -0.35 0.66 -0.09 -1.29 0.00 0.00 177.43 176.25 2o5j h ARG 553 N -1.09 0.21 0.10 0.81 2.43 0.07 -1.20 114.38 115.71 2o5j h ARG 553 Ca -0.08 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 2o5j h ARG 553 Cb 0.68 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 2o5j h ARG 553 CO 0.14 0.14 -0.05 1.25 -1.51 0.00 0.00 179.97 179.94 2o5j h LEU 554 N 0.22 -0.12 -0.68 3.80 5.85 -0.03 -1.16 115.31 123.18 2o5j h LEU 554 Ca 0.50 -0.37 0.14 0.00 0.84 0.00 0.00 57.88 58.99 2o5j h LEU 554 Cb 1.58 0.03 -0.13 0.00 0.37 0.00 0.00 40.66 42.51 2o5j h LEU 554 CO -0.13 0.33 -0.12 0.11 -0.34 0.00 0.00 178.44 178.30 2o5j h LYS 555 N -0.60 0.03 -0.28 1.25 1.57 -0.43 0.76 116.57 118.87 2o5j h LYS 555 Ca -0.01 -0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 2o5j h LYS 555 Cb 0.48 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 2o5j h LYS 555 CO 0.02 0.02 -0.16 -0.22 -0.57 0.00 0.00 179.45 178.54 2o5j h LYS 556 N 0.03 0.49 0.00 3.15 3.64 -1.35 -2.15 116.57 120.38 2o5j h LYS 556 Ca 0.34 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 2o5j h LYS 556 Cb 0.54 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2o5j h LYS 556 CO -0.67 0.64 0.00 -0.07 -2.27 0.00 0.00 179.45 177.08 2o5j h LEU 557 N 0.45 0.00 0.18 5.20 3.38 0.37 -0.52 115.31 124.36 2o5j h LEU 557 Ca 0.08 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.72 2o5j h LEU 557 Cb 0.54 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.30 2o5j h LEU 557 CO 0.04 0.00 -1.61 -0.07 0.09 0.00 0.00 178.44 176.88 2o5j h LEU 558 N 0.00 0.58 -0.06 1.67 3.38 -0.66 -3.34 115.31 116.88 2o5j h LEU 558 Ca 0.00 -0.78 -0.08 0.00 0.09 0.00 0.00 57.88 57.11 2o5j h LEU 558 Cb 0.79 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2o5j h LEU 558 CO 0.00 1.65 -0.28 0.00 0.09 0.00 0.00 178.44 179.89 2o5j h ALA 559 N 0.27 0.12 -0.09 1.53 0.00 -1.33 -3.36 119.26 116.40 2o5j h ALA 559 Ca -0.29 -0.43 0.02 0.00 0.00 0.00 0.00 54.91 54.21 2o5j h ALA 559 Cb 2.08 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.82 2o5j h ALA 559 CO 0.19 0.15 -0.37 1.96 0.00 0.00 0.00 179.25 181.19 2o5j h GLN 560 N -0.20 -0.38 0.00 0.00 4.20 -1.27 -3.47 115.11 113.99 2o5j h GLN 560 Ca -0.02 0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2o5j h GLN 560 Cb 0.93 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.80 2o5j h GLN 560 CO 0.06 -0.25 0.00 0.41 -0.67 0.00 0.00 178.83 178.37 2o5j n GLY 561 N -1.29 1.10 2.75 3.46 0.00 -1.25 -5.12 105.19 104.84 2o5j n GLY 561 Ca -0.04 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 2o5j n GLY 561 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j s ALA 562 N -2.00 2.27 -0.28 4.61 0.00 -1.26 -4.50 121.76 120.59 2o5j s ALA 562 Ca 0.00 -2.61 -0.29 0.00 0.00 0.00 0.00 51.96 49.06 2o5j s ALA 562 Cb 0.00 -1.91 0.01 0.00 0.00 0.00 0.00 23.12 21.22 2o5j s ALA 562 CO 0.00 -2.02 1.16 -1.25 0.00 0.00 0.00 175.76 173.65 2o5j s PRO 563 N 0.38 4.08 0.03 0.00 0.04 -1.26 -4.93 135.00 133.33 2o5j s PRO 563 Ca 0.17 1.25 -0.05 0.00 0.04 0.00 0.00 61.00 62.41 2o5j s PRO 563 Cb -0.24 -3.77 -0.01 0.00 0.04 0.00 0.00 34.50 30.52 2o5j s PRO 563 CO -0.01 -0.89 0.42 0.39 0.04 0.00 0.00 177.00 176.94 2o5j n GLU 564 N 6.87 -0.07 -0.17 4.56 -0.58 -1.26 -1.89 120.64 128.10 2o5j n GLU 564 Ca 0.13 0.41 -0.05 0.00 -0.42 0.00 0.00 57.16 57.24 2o5j n GLU 564 Cb 0.46 -0.61 -0.04 0.00 -0.57 0.00 0.00 31.44 30.68 2o5j n GLU 564 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 2o5j n ILE 565 N -3.38 -0.28 0.25 -3.67 5.41 -1.26 -0.70 119.36 115.72 2o5j n ILE 565 Ca 0.00 1.70 0.08 0.00 1.00 0.00 0.00 62.75 65.53 2o5j n ILE 565 Cb 0.04 -2.16 0.61 0.00 -0.71 0.00 0.00 39.64 37.42 2o5j n ILE 565 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 2o5j h ILE 566 N 0.00 0.94 -0.01 1.39 5.03 -1.79 -1.08 117.51 122.00 2o5j h ILE 566 Ca 0.07 -0.43 -0.00 0.00 -0.12 0.00 0.00 64.86 64.37 2o5j h ILE 566 Cb 0.17 1.24 -0.00 0.00 -3.03 0.00 0.00 36.82 35.20 2o5j h ILE 566 CO -0.39 0.12 -0.00 0.40 -0.68 0.00 0.00 178.15 177.60 2o5j h ILE 567 N 0.00 1.30 -0.02 -0.67 2.04 -0.73 -2.54 117.51 116.88 2o5j h ILE 567 Ca -0.00 -0.87 -0.00 0.00 1.00 0.00 0.00 64.86 64.98 2o5j h ILE 567 Cb 0.23 1.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.19 2o5j h ILE 567 CO 0.02 0.23 0.01 -0.09 0.00 0.00 0.00 178.15 178.31 2o5j h ARG 568 N -0.36 0.04 -0.99 2.37 9.65 -1.21 0.00 114.38 123.89 2o5j h ARG 568 Ca 0.00 -0.01 0.30 0.00 -1.10 0.00 0.00 59.98 59.17 2o5j h ARG 568 Cb 0.37 -0.00 -0.18 0.00 -1.39 0.00 0.00 29.97 28.77 2o5j h ARG 568 CO 0.00 0.24 0.11 -1.71 2.80 0.00 0.00 179.97 181.41 2o5j n ASN 569 N -4.96 -0.03 0.01 -3.80 5.15 -0.43 0.46 115.26 111.66 2o5j n ASN 569 Ca -0.07 1.67 -0.11 0.00 -0.60 0.00 0.00 54.58 55.47 2o5j n ASN 569 Cb 0.13 -0.65 -0.09 0.00 -0.53 0.00 0.00 39.78 38.65 2o5j n ASN 569 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 2o5j h GLU 570 N 0.00 -0.11 -1.10 1.20 3.07 -1.08 -2.85 114.58 113.71 2o5j h GLU 570 Ca 0.64 0.01 0.30 0.00 -0.50 0.00 0.00 59.36 59.81 2o5j h GLU 570 Cb 1.41 0.03 -0.07 0.00 -0.84 0.00 0.00 28.75 29.27 2o5j h GLU 570 CO -0.90 0.42 0.75 0.87 -1.40 0.00 0.00 179.01 178.75 2o5j h LYS 571 N -0.82 0.18 0.77 2.33 1.79 0.10 0.46 116.57 121.39 2o5j h LYS 571 Ca -0.01 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.41 2o5j h LYS 571 Cb 0.59 -0.04 0.01 0.00 -1.58 0.00 0.00 32.23 31.21 2o5j h LYS 571 CO 0.02 0.12 -0.37 0.00 -1.08 0.00 0.00 179.45 178.14 2o5j h ARG 572 N 0.18 -1.00 -0.95 3.15 3.08 0.03 -0.49 114.38 118.38 2o5j h ARG 572 Ca 0.57 0.07 0.21 0.00 0.07 0.00 0.00 59.98 60.90 2o5j h ARG 572 Cb 1.88 0.23 -0.12 0.00 0.08 0.00 0.00 29.97 32.04 2o5j h ARG 572 CO -0.15 -0.67 0.53 0.52 -1.07 0.00 0.00 179.97 179.13 2o5j h MET 573 N -1.05 0.57 0.50 0.04 2.86 -0.31 -1.76 114.93 115.78 2o5j h MET 573 Ca -0.11 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.47 2o5j h MET 573 Cb 0.80 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.33 2o5j h MET 573 CO 0.17 0.38 -0.24 1.25 1.06 0.00 0.00 176.91 179.53 2o5j h LEU 574 N 0.59 -0.57 -0.26 1.22 5.85 -0.11 -1.07 115.31 120.97 2o5j h LEU 574 Ca 0.58 -0.03 0.06 0.00 0.84 0.00 0.00 57.88 59.33 2o5j h LEU 574 Cb 1.02 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 42.12 2o5j h LEU 574 CO -0.45 -0.33 -0.36 -0.61 -0.34 0.00 0.00 178.44 176.35 2o5j h GLN 575 N -0.77 -0.35 -0.61 1.25 5.75 -0.29 0.26 115.11 120.35 2o5j h GLN 575 Ca -0.07 0.02 0.10 0.00 -0.15 0.00 0.00 58.65 58.55 2o5j h GLN 575 Cb 0.56 0.08 -0.11 0.00 1.07 0.00 0.00 27.48 29.08 2o5j h GLN 575 CO 0.11 -0.23 -0.39 1.49 -2.65 0.00 0.00 178.83 177.15 2o5j h GLU 576 N -0.36 -0.18 -0.67 1.69 4.22 -1.31 0.91 114.58 118.88 2o5j h GLU 576 Ca 0.12 0.01 0.10 0.00 0.08 0.00 0.00 59.36 59.67 2o5j h GLU 576 Cb 0.57 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.79 2o5j h GLU 576 CO -0.45 -0.12 0.29 0.00 -2.18 0.00 0.00 179.01 176.54 2o5j h ALA 577 N 0.80 0.90 -0.11 2.92 0.00 -0.19 0.33 119.26 123.92 2o5j h ALA 577 Ca 0.21 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.22 2o5j h ALA 577 Cb 0.56 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2o5j h ALA 577 CO -0.70 -0.13 0.10 0.28 0.00 0.00 0.00 179.25 178.80 2o5j h VAL 578 N 0.50 0.67 -0.03 0.00 2.07 0.12 -0.79 116.25 118.79 2o5j h VAL 578 Ca 0.34 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.82 2o5j h VAL 578 Cb 0.40 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2o5j h VAL 578 CO -0.30 0.00 -0.12 0.44 0.02 0.00 0.00 177.57 177.61 2o5j h ASP 579 N 0.00 0.16 -0.95 0.57 3.32 0.71 -3.28 116.42 116.94 2o5j h ASP 579 Ca 0.05 -0.65 0.10 0.00 0.02 0.00 0.00 57.03 56.55 2o5j h ASP 579 Cb 0.25 -0.05 -0.12 0.00 0.22 0.00 0.00 39.33 39.64 2o5j h ASP 579 CO -0.00 0.78 -0.53 0.00 -1.72 0.00 0.00 179.24 177.77 2o5j n ALA 580 N -2.46 -0.52 -0.04 3.45 0.00 -0.31 0.13 120.51 120.75 2o5j n ALA 580 Ca -0.09 0.83 -0.11 0.00 0.00 0.00 0.00 53.44 54.08 2o5j n ALA 580 Cb 0.39 -0.18 -0.05 0.00 0.00 0.00 0.00 19.45 19.61 2o5j n ALA 580 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 2o5j h LEU 581 N 0.00 0.22 0.64 0.00 -0.00 -1.66 -3.28 115.31 111.23 2o5j h LEU 581 Ca 0.18 -0.14 -0.03 0.00 -0.00 0.00 0.00 57.88 57.89 2o5j h LEU 581 Cb 0.42 -0.06 0.01 0.00 -0.00 0.00 0.00 40.66 41.03 2o5j h LEU 581 CO -0.90 0.30 -0.31 -0.07 -0.00 0.00 0.00 178.44 177.46 2o5j h LEU 582 N 0.13 -0.73 -7.28 0.17 3.38 -1.26 0.15 115.31 109.87 2o5j h LEU 582 Ca 0.06 0.02 -0.27 0.00 0.09 0.00 0.00 57.88 57.77 2o5j h LEU 582 Cb 0.14 0.19 -0.35 0.00 0.09 0.00 0.00 40.66 40.74 2o5j h LEU 582 CO -0.01 -0.34 -0.61 -0.62 0.09 0.00 0.00 178.44 176.95 2o5j s ASP 583 N -4.57 0.56 -0.11 -0.43 -1.08 0.34 0.74 116.67 112.11 2o5j s ASP 583 Ca -0.13 0.37 -0.08 0.00 -0.52 0.00 0.00 52.55 52.19 2o5j s ASP 583 Cb 0.01 0.32 -0.04 0.00 -1.46 0.00 0.00 42.92 41.75 2o5j s ASP 583 CO 0.39 -0.23 0.17 0.21 0.52 0.00 0.00 175.17 176.22 2o5j s ASN 584 N 2.13 6.42 0.00 -0.34 2.47 -1.24 -3.95 114.94 120.43 2o5j s ASN 584 Ca 0.01 0.51 0.00 0.00 0.42 0.00 0.00 52.86 53.79 2o5j s ASN 584 Cb -0.12 -2.09 0.00 0.00 -1.45 0.00 0.00 41.25 37.59 2o5j s ASN 584 CO -0.06 0.38 0.00 0.61 -3.72 0.00 0.00 177.10 174.31 2o5j n GLY 585 N 2.07 3.14 0.24 1.21 0.00 -0.72 -4.87 105.19 106.25 2o5j n GLY 585 Ca -0.19 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.87 2o5j n GLY 585 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2o5j h ARG 586 N 1.59 0.15 -2.72 1.61 2.47 -1.99 -3.36 114.38 112.13 2o5j h ARG 586 Ca 0.00 -0.03 -0.51 0.00 -1.26 0.00 0.00 59.98 58.18 2o5j h ARG 586 Cb 0.00 -0.02 -0.39 0.00 -1.65 0.00 0.00 29.97 27.90 2o5j h ARG 586 CO 0.00 0.27 -0.77 0.50 0.56 0.00 0.00 179.97 180.53 2o5j s ARG 587 N -4.76 0.22 0.53 0.04 3.52 -1.26 -5.12 118.95 112.11 2o5j s ARG 587 Ca -0.05 -0.52 0.00 0.00 -0.13 0.00 0.00 55.73 55.03 2o5j s ARG 587 Cb 0.16 -1.12 0.00 0.00 -1.56 0.00 0.00 34.95 32.43 2o5j s ARG 587 CO 0.71 -1.03 0.00 0.41 -0.81 0.00 0.00 175.30 174.59 2o5j n GLY 588 N 5.21 -2.90 2.84 8.12 0.00 -1.26 -4.90 105.19 112.30 2o5j n GLY 588 Ca -0.05 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.60 2o5j n GLY 588 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j s ALA 589 N -3.61 1.43 0.55 4.61 0.00 -1.26 -1.75 121.76 121.73 2o5j s ALA 589 Ca 0.00 -0.94 -0.20 0.00 0.00 0.00 0.00 51.96 50.82 2o5j s ALA 589 Cb 0.00 -1.24 -0.05 0.00 0.00 0.00 0.00 23.12 21.83 2o5j s ALA 589 CO 0.00 -1.07 1.23 -2.14 0.00 0.00 0.00 175.76 173.79 2o5j s PRO 590 N 1.65 3.18 -0.00 0.00 0.02 -1.26 -4.98 135.00 133.61 2o5j s PRO 590 Ca -0.02 1.91 0.02 0.00 0.02 0.00 0.00 61.00 62.93 2o5j s PRO 590 Cb -0.17 -2.11 -0.00 0.00 0.02 0.00 0.00 34.50 32.24 2o5j s PRO 590 CO -0.07 -1.06 -0.06 0.14 -0.33 0.00 0.00 177.00 175.62 2o5j s VAL 591 N -1.51 0.45 0.39 3.83 -7.23 -1.26 -3.72 120.40 111.34 2o5j s VAL 591 Ca 0.73 -0.26 -0.27 0.00 -1.81 0.00 0.00 61.98 60.36 2o5j s VAL 591 Cb -0.32 -0.38 -0.10 0.00 0.56 0.00 0.00 36.38 36.13 2o5j s VAL 591 CO 0.37 0.11 1.43 -0.89 -0.31 0.00 0.00 175.10 175.81 2o5j s THR 592 N -0.17 2.19 0.48 5.32 2.01 -1.26 -4.88 115.64 119.34 2o5j s THR 592 Ca 0.02 0.19 -0.20 0.00 0.31 0.00 0.00 61.69 62.01 2o5j s THR 592 Cb -0.02 -3.12 -0.13 0.00 0.01 0.00 0.00 72.50 69.24 2o5j s THR 592 CO -0.00 0.04 0.21 0.59 -0.69 0.00 0.00 174.62 174.77 2o5j n ASN 593 N 0.33 -2.32 -0.57 3.53 4.13 -1.26 -4.43 115.26 114.68 2o5j n ASN 593 Ca 0.02 0.76 -0.06 0.00 1.68 0.00 0.00 54.58 56.98 2o5j n ASN 593 Cb 0.40 -0.99 -0.02 0.00 -1.54 0.00 0.00 39.78 37.64 2o5j n ASN 593 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 2o5j n PRO 594 N 0.92 0.00 0.00 3.52 -0.02 -1.26 -4.09 135.00 134.06 2o5j n PRO 594 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 2o5j n PRO 594 Cb 0.44 -0.19 0.00 0.00 -0.02 0.00 0.00 33.50 33.73 2o5j n PRO 594 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o5j n GLY 595 N 0.87 -0.33 2.79 -1.23 0.00 -1.26 -5.08 105.19 100.94 2o5j n GLY 595 Ca 0.08 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.94 2o5j n GLY 595 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2o5j s SER 596 N 0.00 1.26 -0.83 1.61 1.04 -1.26 -5.02 113.70 110.50 2o5j s SER 596 Ca 0.00 -0.32 -0.06 0.00 0.48 0.00 0.00 55.95 56.05 2o5j s SER 596 Cb 0.00 0.57 -0.10 0.00 0.10 0.00 0.00 66.02 66.59 2o5j s SER 596 CO 0.00 -0.34 2.51 0.47 0.98 0.00 0.00 173.24 176.86 2o5j n ASP 597 N 5.33 5.58 -4.63 7.02 8.00 -1.26 -4.06 116.55 132.52 2o5j n ASP 597 Ca -0.04 -2.35 -0.35 0.00 0.71 0.00 0.00 54.79 52.77 2o5j n ASP 597 Cb 0.49 -1.19 -0.10 0.00 -0.02 0.00 0.00 41.12 40.29 2o5j n ASP 597 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2o5j s ARG 598 N 2.56 3.60 -0.15 -1.24 3.52 -1.26 -5.05 118.95 120.93 2o5j s ARG 598 Ca 0.50 -0.39 -0.29 0.00 -0.13 0.00 0.00 55.73 55.41 2o5j s ARG 598 Cb 0.16 -3.02 -0.04 0.00 -1.56 0.00 0.00 34.95 30.48 2o5j s ARG 598 CO -0.03 0.42 1.72 -2.14 -0.81 0.00 0.00 175.30 174.46 2o5j s PRO 599 N -0.07 3.87 -0.01 5.12 0.02 -1.26 -4.18 135.00 138.48 2o5j s PRO 599 Ca 0.05 1.94 -0.31 0.00 0.02 0.00 0.00 61.00 62.70 2o5j s PRO 599 Cb -0.12 -4.07 -0.09 0.00 0.02 0.00 0.00 34.50 30.23 2o5j s PRO 599 CO 0.02 -1.22 1.98 1.28 -0.33 0.00 0.00 177.00 178.72 2o5j n LEU 600 N 8.32 3.93 -4.45 -5.54 4.32 -1.24 -4.74 117.00 117.58 2o5j n LEU 600 Ca 0.20 0.86 -0.46 0.00 -0.02 0.00 0.00 56.01 56.59 2o5j n LEU 600 Cb 0.44 -1.49 -0.10 0.00 -1.62 0.00 0.00 43.42 40.65 2o5j n LEU 600 CO 0.64 0.08 2.00 0.54 -1.22 0.00 0.00 177.39 179.43 2o5j n ARG 601 N 7.44 0.47 -1.91 3.23 1.74 -1.26 -4.87 116.66 121.50 2o5j n ARG 601 Ca 0.22 0.07 -0.30 0.00 -0.77 0.00 0.00 57.85 57.07 2o5j n ARG 601 Cb 0.38 -2.12 0.04 0.00 -1.02 0.00 0.00 32.46 29.74 2o5j n ARG 601 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2o5j s SER 602 N 8.73 5.55 0.19 0.55 1.04 -1.26 -4.51 113.70 123.98 2o5j s SER 602 Ca 1.19 1.15 -0.14 0.00 0.48 0.00 0.00 55.95 58.63 2o5j s SER 602 Cb -0.99 -1.98 0.18 0.00 0.10 0.00 0.00 66.02 63.33 2o5j s SER 602 CO 0.47 -1.27 1.66 -0.07 0.98 0.00 0.00 173.24 175.01 2o5j h LEU 603 N -0.59 -0.35 -0.58 2.42 3.38 -0.61 0.10 115.31 119.08 2o5j h LEU 603 Ca -0.45 0.14 0.12 0.00 0.09 0.00 0.00 57.88 57.78 2o5j h LEU 603 Cb 1.25 0.27 -0.10 0.00 0.09 0.00 0.00 40.66 42.17 2o5j h LEU 603 CO 0.63 -0.13 -0.01 0.74 0.09 0.00 0.00 178.44 179.77 2o5j h THR 604 N 0.05 0.53 -0.54 0.22 2.02 0.11 0.05 112.91 115.35 2o5j h THR 604 Ca 0.25 -0.04 0.02 0.00 0.77 0.00 0.00 66.41 67.41 2o5j h THR 604 Cb 0.38 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 2o5j h THR 604 CO -0.48 0.02 0.33 0.44 0.37 0.00 0.00 175.52 176.21 2o5j h ASP 605 N 0.11 0.55 0.23 4.18 3.32 -1.16 -1.73 116.42 121.93 2o5j h ASP 605 Ca 0.30 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2o5j h ASP 605 Cb 0.47 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.90 2o5j h ASP 605 CO -0.50 0.39 0.00 -0.29 -1.72 0.00 0.00 179.24 177.12 2o5j h ILE 606 N 0.66 0.00 0.00 0.35 2.10 0.11 -2.50 117.51 118.23 2o5j h ILE 606 Ca 0.21 -0.08 0.00 0.00 1.08 0.00 0.00 64.86 66.07 2o5j h ILE 606 Cb -0.01 0.71 0.00 0.00 -1.09 0.00 0.00 36.82 36.43 2o5j h ILE 606 CO -0.08 0.00 -0.61 -0.11 -1.08 0.00 0.00 178.15 176.26 2o5j n LEU 607 N -2.38 0.52 -4.51 2.19 0.00 -0.72 -3.08 117.00 109.00 2o5j n LEU 607 Ca -0.01 -0.47 -0.30 0.00 0.00 0.00 0.00 56.01 55.24 2o5j n LEU 607 Cb 0.10 0.00 -0.11 0.00 0.00 0.00 0.00 43.42 43.41 2o5j n LEU 607 CO 0.14 0.13 -0.47 -0.55 0.00 0.00 0.00 177.39 176.64 2o5j s SER 608 N -2.18 4.05 0.00 1.96 0.15 -0.77 -3.98 113.70 112.94 2o5j s SER 608 Ca 0.04 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.21 2o5j s SER 608 Cb 0.09 -0.65 0.00 0.00 -1.71 0.00 0.00 66.02 63.74 2o5j s SER 608 CO 0.48 0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.72 2o5j n GLY 609 N 0.87 2.35 0.23 9.45 0.00 -1.26 -4.40 105.19 112.42 2o5j n GLY 609 Ca -0.15 -2.11 -0.12 0.00 0.00 0.00 0.00 46.02 43.65 2o5j n GLY 609 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2o5j h LYS 610 N 0.00 -0.33 -2.22 1.61 3.64 -1.98 -2.43 116.57 114.87 2o5j h LYS 610 Ca 0.00 0.02 -0.76 0.00 -1.27 0.00 0.00 60.65 58.65 2o5j h LYS 610 Cb 0.00 0.07 -0.30 0.00 -0.41 0.00 0.00 32.23 31.59 2o5j h LYS 610 CO 0.00 -0.22 0.66 0.00 -2.27 0.00 0.00 179.45 177.62 2o5j n GLN 611 N -5.31 4.74 -1.62 1.90 10.64 -1.26 -4.77 117.38 121.69 2o5j n GLN 611 Ca -0.06 -4.61 -0.02 0.00 -1.83 0.00 0.00 57.00 50.48 2o5j n GLN 611 Cb 0.23 -2.40 0.00 0.00 -0.86 0.00 0.00 30.24 27.21 2o5j n GLN 611 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2o5j n GLY 612 N -0.15 2.83 0.14 2.61 0.00 -0.91 -5.00 105.19 104.71 2o5j n GLY 612 Ca 0.44 -2.17 -0.23 0.00 0.00 0.00 0.00 46.02 44.06 2o5j n GLY 612 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2o5j h ARG 613 N 0.00 0.45 0.00 1.61 9.65 -1.72 -2.18 114.38 122.19 2o5j h ARG 613 Ca -0.03 -0.76 -0.02 0.00 -1.10 0.00 0.00 59.98 58.06 2o5j h ARG 613 Cb 0.12 0.28 -0.00 0.00 -1.39 0.00 0.00 29.97 28.98 2o5j h ARG 613 CO 0.05 1.36 -0.12 0.74 2.80 0.00 0.00 179.97 184.80 2o5j h PHE 614 N 0.12 0.00 0.00 2.20 0.04 -1.85 -2.00 116.94 115.45 2o5j h PHE 614 Ca -0.30 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.22 2o5j h PHE 614 Cb 2.12 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 40.23 2o5j h PHE 614 CO 0.11 0.12 -1.48 -0.09 -0.60 0.00 0.00 178.31 176.37 2o5j h ARG 615 N 0.00 0.00 -0.96 1.51 2.43 -1.77 -3.14 114.38 112.46 2o5j h ARG 615 Ca -0.00 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2o5j h ARG 615 Cb 0.38 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.87 2o5j h ARG 615 CO 0.02 0.56 0.62 0.37 -1.51 0.00 0.00 179.97 180.03 2o5j h GLN 616 N 0.00 1.18 0.01 0.20 5.75 -0.69 -1.98 115.11 119.57 2o5j h GLN 616 Ca -0.20 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.21 2o5j h GLN 616 Cb 1.88 -0.27 0.00 0.00 1.07 0.00 0.00 27.48 30.16 2o5j h GLN 616 CO 0.08 0.78 -0.05 -0.91 -2.65 0.00 0.00 178.83 176.08 2o5j h ASN 617 N 1.21 0.04 -0.28 -0.69 4.21 -1.60 -2.94 115.58 115.53 2o5j h ASN 617 Ca 0.38 -0.89 0.05 0.00 1.21 0.00 0.00 56.30 57.06 2o5j h ASN 617 Cb -0.01 -0.01 -0.05 0.00 -1.12 0.00 0.00 38.32 37.13 2o5j h ASN 617 CO -0.12 0.92 -0.04 0.25 -1.29 0.00 0.00 177.43 177.15 2o5j h LEU 618 N -0.84 -0.20 -0.58 1.61 6.46 -1.50 -2.34 115.31 117.92 2o5j h LEU 618 Ca -0.01 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.83 2o5j h LEU 618 Cb 0.93 0.15 0.00 0.00 -0.73 0.00 0.00 40.66 41.01 2o5j h LEU 618 CO 0.01 -0.07 -0.10 0.18 -0.62 0.00 0.00 178.44 177.84 2o5j n LEU 619 N -5.21 1.00 -2.89 2.25 4.77 -0.75 -4.86 117.00 111.31 2o5j n LEU 619 Ca -0.00 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2o5j n LEU 619 Cb 0.16 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2o5j n LEU 619 CO 0.22 0.18 -0.20 0.61 -1.33 0.00 0.00 177.39 176.86 2o5j n GLY 620 N 1.23 0.00 0.08 -0.72 0.00 -0.88 -4.90 105.19 100.00 2o5j n GLY 620 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 2o5j n GLY 620 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o5j h LYS 621 N 4.18 0.04 -3.50 1.61 1.79 -1.89 -3.45 116.57 115.34 2o5j h LYS 621 Ca 0.00 -0.06 -0.48 0.00 -2.18 0.00 0.00 60.65 57.93 2o5j h LYS 621 Cb 0.41 0.02 -0.40 0.00 -1.58 0.00 0.00 32.23 30.68 2o5j h LYS 621 CO 0.00 0.69 -0.76 1.03 -1.08 0.00 0.00 179.45 179.32 2o5j s ARG 622 N -2.62 0.53 0.49 3.15 0.52 -1.26 -5.10 118.95 114.66 2o5j s ARG 622 Ca -0.05 -0.20 -0.23 0.00 -0.52 0.00 0.00 55.73 54.73 2o5j s ARG 622 Cb 0.08 -1.71 -0.06 0.00 0.52 0.00 0.00 34.95 33.78 2o5j s ARG 622 CO 0.82 -0.54 1.27 0.08 0.02 0.00 0.00 175.30 176.94 2o5j s VAL 623 N 1.94 2.59 -0.05 3.52 1.01 -1.26 -5.00 120.40 123.16 2o5j s VAL 623 Ca 0.01 0.45 0.13 0.00 0.00 0.00 0.00 61.98 62.58 2o5j s VAL 623 Cb -0.15 -3.23 -0.20 0.00 0.00 0.00 0.00 36.38 32.80 2o5j s VAL 623 CO -0.07 0.00 0.79 0.44 0.00 0.00 0.00 175.10 176.26 2o5j h ASP 624 N 1.84 0.00 -3.35 3.32 3.32 -2.00 -3.40 116.42 116.15 2o5j h ASP 624 Ca -0.50 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 55.91 2o5j h ASP 624 Cb 1.27 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.42 2o5j h ASP 624 CO 0.59 0.89 -0.48 -0.31 -1.72 0.00 0.00 179.24 178.21 2o5j s TYR 625 N -2.70 3.59 0.17 4.55 1.51 -1.26 -5.04 117.35 118.17 2o5j s TYR 625 Ca -0.03 -3.24 0.02 0.00 -1.01 0.00 0.00 57.07 52.80 2o5j s TYR 625 Cb 0.08 -2.85 -0.05 0.00 -0.11 0.00 0.00 41.96 39.04 2o5j s TYR 625 CO 0.82 -0.62 0.00 -1.54 -1.11 0.00 0.00 175.55 173.10 2o5j s SER 626 N -0.98 1.18 0.16 2.29 1.04 -1.26 -2.97 113.70 113.16 2o5j s SER 626 Ca 0.24 -1.17 -0.20 0.00 0.48 0.00 0.00 55.95 55.31 2o5j s SER 626 Cb -0.08 0.12 0.05 0.00 0.10 0.00 0.00 66.02 66.21 2o5j s SER 626 CO -0.13 -0.57 0.53 -0.83 0.98 0.00 0.00 173.24 173.21 2o5j s GLY 627 N -3.17 -0.37 -0.27 7.32 0.00 0.44 -4.91 107.32 106.37 2o5j s GLY 627 Ca 0.24 0.12 -0.14 0.00 0.00 0.00 0.00 44.72 44.94 2o5j s GLY 627 CO 0.04 -0.09 0.64 1.09 0.00 0.00 0.00 173.10 174.78 2o5j s ARG 628 N -3.80 0.63 0.34 2.90 1.70 -1.26 0.11 118.95 119.57 2o5j s ARG 628 Ca 0.04 1.24 -0.02 0.00 -0.47 0.00 0.00 55.73 56.52 2o5j s ARG 628 Cb -0.00 0.31 0.01 0.00 -0.57 0.00 0.00 34.95 34.70 2o5j s ARG 628 CO -0.09 -0.17 0.48 0.45 -1.08 0.00 0.00 175.30 174.89 2o5j n SER 629 N 4.63 -1.35 -4.76 -2.89 2.88 -1.20 -5.02 113.62 105.91 2o5j n SER 629 Ca -0.18 -2.84 -0.39 0.00 -1.33 0.00 0.00 58.87 54.13 2o5j n SER 629 Cb 0.56 2.51 -0.05 0.00 -0.75 0.00 0.00 64.21 66.47 2o5j n SER 629 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2o5j s VAL 630 N -2.79 3.85 0.06 2.46 1.01 -1.26 -2.94 120.40 120.79 2o5j s VAL 630 Ca 0.28 1.75 -0.04 0.00 0.00 0.00 0.00 61.98 63.98 2o5j s VAL 630 Cb -0.01 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 2o5j s VAL 630 CO 0.20 0.33 0.27 0.27 0.00 0.00 0.00 175.10 176.17 2o5j s ILE 631 N -1.30 5.31 -0.09 2.22 -4.36 -1.26 -0.75 121.20 120.97 2o5j s ILE 631 Ca 0.46 -0.08 -0.12 0.00 -0.26 0.00 0.00 60.65 60.65 2o5j s ILE 631 Cb -0.26 -3.60 0.03 0.00 1.25 0.00 0.00 42.46 39.88 2o5j s ILE 631 CO 0.33 0.21 0.31 -0.69 0.24 0.00 0.00 174.94 175.34 2o5j s VAL 632 N -1.46 0.02 0.32 8.37 1.01 -0.05 -4.80 120.40 123.81 2o5j s VAL 632 Ca 0.33 -0.15 -0.28 0.00 0.00 0.00 0.00 61.98 61.88 2o5j s VAL 632 Cb -0.13 -0.50 -0.13 0.00 0.00 0.00 0.00 36.38 35.63 2o5j s VAL 632 CO 0.22 -0.08 1.23 0.55 0.00 0.00 0.00 175.10 177.02 2o5j n VAL 633 N 2.43 1.87 -3.18 2.92 3.14 -1.26 -1.76 118.33 122.49 2o5j n VAL 633 Ca -0.15 -0.47 -0.24 0.00 -2.96 0.00 0.00 64.34 60.52 2o5j n VAL 633 Cb 0.57 -1.41 -0.05 0.00 -1.06 0.00 0.00 33.84 31.89 2o5j n VAL 633 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2o5j n GLY 634 N 1.04 4.19 0.26 7.55 0.00 -0.33 -4.72 105.19 113.19 2o5j n GLY 634 Ca 0.07 -2.18 0.13 0.00 0.00 0.00 0.00 46.02 44.04 2o5j n GLY 634 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2o5j n PRO 635 N 0.56 -0.06 0.16 1.61 -0.02 -1.26 -0.89 135.00 135.09 2o5j n PRO 635 Ca 0.27 1.14 0.04 0.00 -2.02 0.00 0.00 63.50 62.93 2o5j n PRO 635 Cb 0.50 -1.84 0.10 0.00 -0.02 0.00 0.00 33.50 32.24 2o5j n PRO 635 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2o5j h GLN 636 N 0.00 0.00 -6.94 -0.52 4.20 -1.97 -3.46 115.11 106.42 2o5j h GLN 636 Ca 0.49 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.63 2o5j h GLN 636 Cb 1.05 0.00 0.16 0.00 0.30 0.00 0.00 27.48 28.99 2o5j h GLN 636 CO -0.71 0.41 0.28 -0.11 -0.67 0.00 0.00 178.83 178.03 2o5j n LEU 637 N -3.24 4.64 -4.80 1.46 7.94 -0.07 -5.01 117.00 117.92 2o5j n LEU 637 Ca 0.02 0.82 -0.29 0.00 -1.11 0.00 0.00 56.01 55.44 2o5j n LEU 637 Cb 0.67 -1.46 -0.06 0.00 0.53 0.00 0.00 43.42 43.10 2o5j n LEU 637 CO 0.39 -1.50 -0.24 -0.54 -1.11 0.00 0.00 177.39 174.39 2o5j s LYS 638 N -3.00 2.94 0.46 1.96 -0.14 -1.26 -4.92 119.74 115.79 2o5j s LYS 638 Ca 0.78 -0.70 0.34 0.00 -1.36 0.00 0.00 55.97 55.03 2o5j s LYS 638 Cb -0.40 -2.74 1.52 0.00 -1.68 0.00 0.00 37.83 34.52 2o5j s LYS 638 CO 0.44 0.55 1.59 1.37 -0.76 0.00 0.00 175.35 178.54 2o5j h LEU 639 N 3.07 0.18 -1.06 3.17 8.10 -1.95 0.83 115.31 127.66 2o5j h LEU 639 Ca -0.47 0.14 0.06 0.00 0.11 0.00 0.00 57.88 57.72 2o5j h LEU 639 Cb 1.17 0.14 -0.06 0.00 -0.44 0.00 0.00 40.66 41.47 2o5j h LEU 639 CO 0.66 -0.22 0.63 -0.74 -4.11 0.00 0.00 178.44 174.66 2o5j h HIS 640 N 0.02 1.15 -0.77 0.17 2.76 -1.94 -3.39 115.15 113.16 2o5j h HIS 640 Ca 0.88 0.03 -0.66 0.00 -2.20 0.00 0.00 60.37 58.43 2o5j h HIS 640 Cb 2.90 -0.38 -0.12 0.00 1.55 0.00 0.00 27.41 31.36 2o5j h HIS 640 CO -0.01 0.60 -0.52 -0.65 -1.30 0.00 0.00 177.93 176.05 2o5j s GLN 641 N -5.99 2.14 -0.02 5.26 1.11 0.29 -1.22 119.66 121.23 2o5j s GLN 641 Ca -0.12 -2.28 -0.09 0.00 0.01 0.00 0.00 55.36 52.88 2o5j s GLN 641 Cb 0.20 -1.62 0.01 0.00 -1.01 0.00 0.00 33.01 30.59 2o5j s GLN 641 CO 0.81 -0.29 0.20 0.00 0.01 0.00 0.00 175.29 176.02 2o5j s GLY 643 N -1.07 1.58 -0.16 0.00 0.00 0.29 -0.59 107.32 107.36 2o5j s GLY 643 Ca -0.12 -0.66 -0.01 0.00 0.00 0.00 0.00 44.72 43.94 2o5j s GLY 643 CO 0.02 1.90 -0.12 -2.27 0.00 0.00 0.00 173.10 172.63 2o5j s LEU 644 N 3.39 2.62 0.15 0.66 2.96 -1.12 -0.19 118.68 127.15 2o5j s LEU 644 Ca 0.35 -0.42 -0.33 0.00 -0.22 0.00 0.00 54.13 53.51 2o5j s LEU 644 Cb -0.12 -1.61 -0.13 0.00 0.50 0.00 0.00 46.19 44.83 2o5j s LEU 644 CO 0.20 0.08 1.64 -2.65 -1.32 0.00 0.00 176.35 174.30 2o5j n PRO 645 N 4.07 2.30 -0.30 0.98 -0.02 -1.26 -1.69 135.00 139.09 2o5j n PRO 645 Ca -0.19 0.83 -0.02 0.00 -2.02 0.00 0.00 63.50 62.10 2o5j n PRO 645 Cb 0.52 -2.62 0.10 0.00 -0.02 0.00 0.00 33.50 31.47 2o5j n PRO 645 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2o5j h LYS 646 N 6.40 1.01 -0.65 -0.52 3.64 -1.38 0.11 116.57 125.18 2o5j h LYS 646 Ca -0.45 -0.06 0.13 0.00 -1.27 0.00 0.00 60.65 59.00 2o5j h LYS 646 Cb 1.24 -0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 32.80 2o5j h LYS 646 CO 0.91 0.67 0.44 0.00 -2.27 0.00 0.00 179.45 179.19 2o5j h ARG 647 N 1.04 0.32 0.13 1.90 3.08 -1.85 0.24 114.38 119.23 2o5j h ARG 647 Ca 0.33 -0.02 -0.21 0.00 0.07 0.00 0.00 59.98 60.15 2o5j h ARG 647 Cb -0.01 -0.07 0.02 0.00 0.08 0.00 0.00 29.97 29.99 2o5j h ARG 647 CO -0.11 0.21 -0.89 0.52 -1.07 0.00 0.00 179.97 178.63 2o5j h MET 648 N 0.33 0.37 -0.58 0.04 2.86 -1.55 -3.32 114.93 113.07 2o5j h MET 648 Ca 0.31 -0.58 0.09 0.00 -2.06 0.00 0.00 59.70 57.46 2o5j h MET 648 Cb 0.76 0.21 -0.03 0.00 0.06 0.00 0.00 31.60 32.59 2o5j h MET 648 CO -0.08 1.26 0.39 0.00 1.06 0.00 0.00 176.91 179.54 2o5j h ALA 649 N 0.14 1.97 -0.13 6.32 0.00 0.35 -1.82 119.26 126.10 2o5j h ALA 649 Ca -0.15 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2o5j h ALA 649 Cb 1.67 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 2o5j h ALA 649 CO 0.17 -0.09 0.07 -0.07 0.00 0.00 0.00 179.25 179.33 2o5j h LEU 650 N 0.44 0.16 -0.02 0.00 3.38 -1.10 0.23 115.31 118.40 2o5j h LEU 650 Ca 0.26 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 2o5j h LEU 650 Cb 0.46 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 2o5j h LEU 650 CO -0.07 0.19 -0.01 -0.08 0.09 0.00 0.00 178.44 178.56 2o5j h GLU 651 N 0.11 0.04 0.43 1.13 4.22 -1.56 -1.65 114.58 117.31 2o5j h GLU 651 Ca 0.04 -0.02 -0.01 0.00 0.08 0.00 0.00 59.36 59.46 2o5j h GLU 651 Cb 0.07 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2o5j h GLU 651 CO -0.01 0.40 -0.40 -0.07 -2.18 0.00 0.00 179.01 176.75 2o5j h LEU 652 N -0.32 -1.09 -3.00 1.64 4.07 -1.29 -2.61 115.31 112.71 2o5j h LEU 652 Ca 0.01 0.09 -0.25 0.00 0.08 0.00 0.00 57.88 57.80 2o5j h LEU 652 Cb 0.39 0.36 -0.15 0.00 1.08 0.00 0.00 40.66 42.34 2o5j h LEU 652 CO 0.00 -0.56 0.32 0.49 -1.08 0.00 0.00 178.44 177.61 2o5j n PHE 653 N -5.50 1.47 0.35 1.13 3.72 0.81 -4.63 117.46 114.81 2o5j n PHE 653 Ca -0.11 -1.23 -0.17 0.00 -0.05 0.00 0.00 57.45 55.90 2o5j n PHE 653 Cb 0.40 -0.62 -0.08 0.00 -0.94 0.00 0.00 39.48 38.24 2o5j n PHE 653 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2o5j h LYS 654 N 0.58 -0.96 -0.29 -1.08 3.64 -0.89 -0.65 116.57 116.92 2o5j h LYS 654 Ca 0.30 0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.80 2o5j h LYS 654 Cb 1.79 0.22 -0.05 0.00 -0.41 0.00 0.00 32.23 33.79 2o5j h LYS 654 CO 0.55 -0.64 -0.02 -1.35 -2.27 0.00 0.00 179.45 175.72 2o5j h PRO 655 N -1.00 0.06 -0.71 1.90 0.11 -1.85 0.13 132.00 130.65 2o5j h PRO 655 Ca -0.08 -0.00 0.20 0.00 0.11 0.00 0.00 66.00 66.22 2o5j h PRO 655 Cb 0.81 -0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.88 2o5j h PRO 655 CO 0.06 0.04 0.51 0.74 -0.21 0.00 0.00 178.00 179.14 2o5j h PHE 656 N 0.06 0.05 0.15 0.65 -1.00 -1.89 -1.54 116.94 113.43 2o5j h PHE 656 Ca 0.14 0.00 -0.22 0.00 2.81 0.00 0.00 57.97 60.70 2o5j h PHE 656 Cb 0.19 -0.02 0.02 0.00 3.61 0.00 0.00 35.95 39.75 2o5j h PHE 656 CO -0.23 0.02 -1.01 1.25 -1.61 0.00 0.00 178.31 176.72 2o5j h LEU 657 N 0.04 0.49 -0.60 1.54 5.85 0.63 -3.20 115.31 120.06 2o5j h LEU 657 Ca 0.34 -0.93 0.12 0.00 0.84 0.00 0.00 57.88 58.25 2o5j h LEU 657 Cb 1.30 -0.16 -0.11 0.00 0.37 0.00 0.00 40.66 42.05 2o5j h LEU 657 CO -0.02 1.48 -0.17 -0.07 -0.34 0.00 0.00 178.44 179.32 2o5j h LEU 658 N -0.30 -0.62 -0.13 2.25 3.38 0.20 0.27 115.31 120.36 2o5j h LEU 658 Ca -0.19 0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2o5j h LEU 658 Cb 1.73 0.39 -0.01 0.00 0.09 0.00 0.00 40.66 42.86 2o5j h LEU 658 CO 0.15 -0.21 0.06 0.50 0.09 0.00 0.00 178.44 179.02 2o5j h LYS 659 N -0.02 0.18 -0.34 1.13 1.63 -1.65 -2.44 116.57 115.07 2o5j h LYS 659 Ca 0.28 -0.03 0.10 0.00 -0.85 0.00 0.00 60.65 60.15 2o5j h LYS 659 Cb 0.46 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.04 2o5j h LYS 659 CO -0.63 0.25 0.26 -0.22 -3.45 0.00 0.00 179.45 175.66 2o5j h LYS 660 N 0.07 0.00 -0.53 1.90 3.64 -1.12 0.88 116.57 121.41 2o5j h LYS 660 Ca 0.04 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 2o5j h LYS 660 Cb 0.13 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 2o5j h LYS 660 CO -0.01 0.00 0.09 0.52 -2.27 0.00 0.00 179.45 177.78 2o5j h MET 661 N 0.00 0.88 -0.17 1.90 2.86 -0.05 -2.94 114.93 117.42 2o5j h MET 661 Ca 0.16 -0.24 -0.12 0.00 -2.06 0.00 0.00 59.70 57.45 2o5j h MET 661 Cb 0.68 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 2o5j h MET 661 CO -0.00 0.86 -0.40 0.93 1.06 0.00 0.00 176.91 179.36 2o5j h GLU 662 N 0.77 0.38 0.00 1.72 5.08 -0.68 -2.64 114.58 119.21 2o5j h GLU 662 Ca 0.16 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2o5j h GLU 662 Cb 0.40 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 2o5j h GLU 662 CO 0.01 0.72 -0.02 0.93 -1.00 0.00 0.00 179.01 179.65 2o5j h GLU 663 N 0.32 0.00 -5.78 2.33 4.39 -1.16 -3.43 114.58 111.25 2o5j h GLU 663 Ca 0.03 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 59.13 2o5j h GLU 663 Cb 0.85 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.43 2o5j h GLU 663 CO 0.07 0.02 -0.36 0.15 -1.16 0.00 0.00 179.01 177.73 2o5j s LYS 664 N -3.98 2.25 0.00 2.33 1.02 -1.00 -5.06 119.74 115.30 2o5j s LYS 664 Ca -0.02 -2.07 0.28 0.00 0.02 0.00 0.00 55.97 54.18 2o5j s LYS 664 Cb 0.12 -1.98 1.15 0.00 -0.52 0.00 0.00 37.83 36.59 2o5j s LYS 664 CO 0.50 -0.52 1.81 0.41 -0.92 0.00 0.00 175.35 176.63 2o5j n GLY 665 N -1.62 -0.99 0.36 -3.33 0.00 -1.26 -4.11 105.19 94.24 2o5j n GLY 665 Ca -0.05 -0.27 0.15 0.00 0.00 0.00 0.00 46.02 45.85 2o5j n GLY 665 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2o5j h ILE 666 N 0.51 0.83 -3.27 -0.61 2.04 -1.93 -3.42 117.51 111.66 2o5j h ILE 666 Ca 0.00 -0.08 -0.17 0.00 1.00 0.00 0.00 64.86 65.61 2o5j h ILE 666 Cb 0.39 0.57 -0.25 0.00 -0.74 0.00 0.00 36.82 36.79 2o5j h ILE 666 CO 0.00 0.04 -0.47 0.00 0.00 0.00 0.00 178.15 177.73 2o5j s ALA 667 N -5.24 -0.50 -0.03 1.87 0.00 -1.21 -5.00 121.76 111.65 2o5j s ALA 667 Ca -0.07 0.45 -0.25 0.00 0.00 0.00 0.00 51.96 52.10 2o5j s ALA 667 Cb 0.20 -0.24 -0.20 0.00 0.00 0.00 0.00 23.12 22.87 2o5j s ALA 667 CO 0.74 -0.13 1.18 -1.35 0.00 0.00 0.00 175.76 176.21 2o5j h PRO 668 N 5.45 0.10 -4.59 0.00 0.11 -1.88 -3.35 132.00 127.84 2o5j h PRO 668 Ca -0.27 -0.07 -0.34 0.00 0.11 0.00 0.00 66.00 65.43 2o5j h PRO 668 Cb 1.19 0.01 -0.12 0.00 0.11 0.00 0.00 31.00 32.19 2o5j h PRO 668 CO 0.38 0.67 -0.45 0.54 -0.21 0.00 0.00 178.00 178.94 2o5j s ASN 669 N -5.95 0.99 0.04 -2.05 4.22 -1.26 -4.87 114.94 106.06 2o5j s ASN 669 Ca -0.16 -1.55 -0.18 0.00 -2.14 0.00 0.00 52.86 48.83 2o5j s ASN 669 Cb 0.02 0.53 -0.08 0.00 1.28 0.00 0.00 41.25 42.99 2o5j s ASN 669 CO 0.70 -1.05 1.28 0.58 -2.04 0.00 0.00 177.10 176.57 2o5j h VAL 670 N 2.28 0.00 -0.97 3.54 2.07 -1.93 0.44 116.25 121.69 2o5j h VAL 670 Ca -0.29 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.47 2o5j h VAL 670 Cb 1.24 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.94 2o5j h VAL 670 CO 0.42 0.00 0.64 0.11 0.02 0.00 0.00 177.57 178.76 2o5j h LYS 671 N -0.48 0.33 -0.16 1.57 1.57 -1.98 0.29 116.57 117.71 2o5j h LYS 671 Ca -0.03 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.70 2o5j h LYS 671 Cb 0.43 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 2o5j h LYS 671 CO -0.06 0.22 -0.04 0.00 -0.57 0.00 0.00 179.45 179.00 2o5j h ALA 672 N 1.59 0.23 -0.27 3.86 0.00 -1.80 -2.25 119.26 120.61 2o5j h ALA 672 Ca 0.51 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 2o5j h ALA 672 Cb 1.41 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 2o5j h ALA 672 CO -0.19 -0.02 0.12 0.00 0.00 0.00 0.00 179.25 179.17 2o5j h ALA 673 N 0.72 1.71 0.37 0.00 0.00 0.30 -1.05 119.26 121.30 2o5j h ALA 673 Ca 0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2o5j h ALA 673 Cb 0.47 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2o5j h ALA 673 CO 0.02 0.24 -0.18 -0.09 0.00 0.00 0.00 179.25 179.24 2o5j h ARG 674 N 0.38 -0.48 -0.70 0.00 9.65 -0.42 -3.11 114.38 119.70 2o5j h ARG 674 Ca 0.10 0.03 0.08 0.00 -1.10 0.00 0.00 59.98 59.09 2o5j h ARG 674 Cb 0.06 0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.70 2o5j h ARG 674 CO -0.01 -0.16 0.46 0.00 2.80 0.00 0.00 179.97 183.05 2o5j h ARG 675 N -0.83 0.61 -0.12 0.20 3.08 -1.21 -0.14 114.38 115.97 2o5j h ARG 675 Ca -0.05 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.00 2o5j h ARG 675 Cb 0.53 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.44 2o5j h ARG 675 CO 0.08 0.40 0.10 1.98 -1.07 0.00 0.00 179.97 181.47 2o5j h MET 676 N 0.63 0.00 -0.04 0.04 4.05 -1.14 -2.57 114.93 115.89 2o5j h MET 676 Ca 0.31 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.73 2o5j h MET 676 Cb 0.41 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.21 2o5j h MET 676 CO -0.11 0.00 0.00 1.28 0.23 0.00 0.00 176.91 178.31 2o5j n LEU 677 N -4.09 1.77 0.23 3.39 4.77 -0.17 -4.24 117.00 118.66 2o5j n LEU 677 Ca -0.00 -1.12 0.16 0.00 -0.03 0.00 0.00 56.01 55.01 2o5j n LEU 677 Cb 0.22 -0.02 0.69 0.00 -2.33 0.00 0.00 43.42 41.98 2o5j n LEU 677 CO 0.30 0.37 0.96 1.05 -1.33 0.00 0.00 177.39 178.75 2o5j h GLU 678 N 1.51 0.00 -6.60 3.23 4.11 -0.85 -3.41 114.58 112.56 2o5j h GLU 678 Ca 0.00 0.00 -0.70 0.00 0.07 0.00 0.00 59.36 58.73 2o5j h GLU 678 Cb 0.36 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 29.31 2o5j h GLU 678 CO 0.00 0.00 -0.89 -0.98 0.07 0.00 0.00 179.01 177.21 2o5j s ARG 679 N -3.61 2.12 0.26 1.06 1.70 -1.26 -5.04 118.95 114.17 2o5j s ARG 679 Ca 0.01 -0.93 -0.01 0.00 -0.47 0.00 0.00 55.73 54.34 2o5j s ARG 679 Cb 0.09 -2.04 0.33 0.00 -0.57 0.00 0.00 34.95 32.76 2o5j s ARG 679 CO 0.45 0.56 1.70 1.96 -1.08 0.00 0.00 175.30 178.89 2o5j h GLN 680 N 5.50 0.63 0.00 3.89 4.20 -1.93 -2.75 115.11 124.65 2o5j h GLN 680 Ca -0.43 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.05 2o5j h GLN 680 Cb 1.12 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.86 2o5j h GLN 680 CO 0.47 0.79 0.00 0.54 -0.67 0.00 0.00 178.83 179.96 2o5j n ARG 681 N -4.14 0.82 0.00 1.46 1.74 -1.26 -3.31 116.66 111.98 2o5j n ARG 681 Ca 0.00 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.18 2o5j n ARG 681 Cb 0.39 -1.41 0.03 0.00 -1.02 0.00 0.00 32.46 30.45 2o5j n ARG 681 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2o5j n ASP 682 N -0.91 2.23 -4.66 0.55 9.92 -1.04 -4.94 116.55 117.70 2o5j n ASP 682 Ca 0.16 -1.61 -0.43 0.00 -0.53 0.00 0.00 54.79 52.38 2o5j n ASP 682 Cb 0.07 0.28 -0.02 0.00 -0.64 0.00 0.00 41.12 40.82 2o5j n ASP 682 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2o5j s ILE 683 N -2.04 4.60 0.39 0.53 1.09 -1.21 -4.89 121.20 119.67 2o5j s ILE 683 Ca 0.20 1.92 -0.24 0.00 -1.10 0.00 0.00 60.65 61.42 2o5j s ILE 683 Cb 0.17 -4.30 -0.10 0.00 -1.06 0.00 0.00 42.46 37.17 2o5j s ILE 683 CO 0.41 -0.24 1.00 -0.54 -0.10 0.00 0.00 174.94 175.47 2o5j s LYS 684 N 3.33 4.28 0.65 2.79 1.02 -1.26 -4.90 119.74 125.65 2o5j s LYS 684 Ca 0.46 1.38 0.25 0.00 0.02 0.00 0.00 55.97 58.08 2o5j s LYS 684 Cb -0.15 -2.53 1.35 0.00 -0.52 0.00 0.00 37.83 35.98 2o5j s LYS 684 CO 0.09 -0.01 1.77 -0.44 -0.92 0.00 0.00 175.35 175.84 2o5j h ASP 685 N 2.54 0.00 -0.21 2.83 3.32 -2.03 0.11 116.42 122.98 2o5j h ASP 685 Ca -0.48 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 2o5j h ASP 685 Cb 1.20 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 2o5j h ASP 685 CO 0.63 0.00 0.07 -0.33 -1.72 0.00 0.00 179.24 177.88 2o5j h GLU 686 N 0.00 0.40 -0.53 3.56 5.08 -2.01 -2.62 114.58 118.46 2o5j h GLU 686 Ca 0.06 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2o5j h GLU 686 Cb 1.03 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 2o5j h GLU 686 CO -0.00 0.38 0.29 0.28 -1.00 0.00 0.00 179.01 178.96 2o5j h VAL 687 N 0.40 1.18 -0.46 3.13 2.07 -1.15 -2.38 116.25 119.04 2o5j h VAL 687 Ca 0.10 -0.47 0.07 0.00 0.82 0.00 0.00 66.70 67.21 2o5j h VAL 687 Cb 0.16 0.52 -0.06 0.00 -1.52 0.00 0.00 31.29 30.39 2o5j h VAL 687 CO -0.00 0.20 0.13 -0.50 0.02 0.00 0.00 177.57 177.42 2o5j h TRP 688 N 0.71 0.23 -0.95 1.57 -0.00 -1.62 0.31 115.95 116.20 2o5j h TRP 688 Ca 0.19 0.03 0.06 0.00 -0.00 0.00 0.00 58.89 59.17 2o5j h TRP 688 Cb 0.06 -0.03 -0.06 0.00 -0.00 0.00 0.00 29.16 29.12 2o5j h TRP 688 CO -0.01 0.06 0.62 -0.44 -0.00 0.00 0.00 178.44 178.66 2o5j h ASP 689 N 0.29 0.97 0.30 -3.49 5.19 -1.44 0.05 116.42 118.28 2o5j h ASP 689 Ca 0.22 0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.62 2o5j h ASP 689 Cb 0.25 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.56 2o5j h ASP 689 CO -0.25 0.62 -0.14 0.00 -3.12 0.00 0.00 179.24 176.34 2o5j h ALA 690 N 1.48 -0.40 -0.54 3.45 0.00 -0.70 -2.16 119.26 120.39 2o5j h ALA 690 Ca 0.41 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.20 2o5j h ALA 690 Cb 0.18 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 2o5j h ALA 690 CO -0.16 -0.60 0.28 1.25 0.00 0.00 0.00 179.25 180.02 2o5j h LEU 691 N -0.65 0.40 -2.05 0.00 7.12 -0.65 -0.51 115.31 118.97 2o5j h LEU 691 Ca -0.04 0.03 0.07 0.00 0.13 0.00 0.00 57.88 58.06 2o5j h LEU 691 Cb 0.46 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.53 2o5j h LEU 691 CO 0.07 0.27 0.17 -0.08 -0.13 0.00 0.00 178.44 178.74 2o5j h GLU 692 N 0.53 0.00 0.04 1.25 4.57 -0.97 -0.93 114.58 119.07 2o5j h GLU 692 Ca 0.24 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 58.17 2o5j h GLU 692 Cb 0.14 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 2o5j h GLU 692 CO -0.16 0.00 -1.24 0.93 -1.18 0.00 0.00 179.01 177.35 2o5j h GLU 693 N 0.00 0.09 -0.15 1.92 5.08 -0.50 -3.28 114.58 117.74 2o5j h GLU 693 Ca 0.11 -0.15 -0.18 0.00 -1.00 0.00 0.00 59.36 58.14 2o5j h GLU 693 Cb 0.45 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 2o5j h GLU 693 CO -0.00 0.97 -0.65 0.28 -1.00 0.00 0.00 179.01 178.61 2o5j h VAL 694 N 0.02 1.33 -0.01 3.13 2.07 0.19 -3.07 116.25 119.92 2o5j h VAL 694 Ca -0.11 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.46 2o5j h VAL 694 Cb 1.88 1.92 0.00 0.00 -1.52 0.00 0.00 31.29 33.57 2o5j h VAL 694 CO 0.14 0.60 -0.02 0.00 0.02 0.00 0.00 177.57 178.31 2o5j n ILE 695 N -3.91 0.00 -0.00 4.57 3.06 -0.78 -4.68 119.36 117.62 2o5j n ILE 695 Ca -0.04 -0.12 -0.00 0.00 -2.50 0.00 0.00 62.75 60.08 2o5j n ILE 695 Cb 0.66 0.02 -0.00 0.00 0.54 0.00 0.00 39.64 40.86 2o5j n ILE 695 CO 0.00 0.00 0.00 1.57 -2.50 0.00 0.00 176.55 175.62 2o5j n HIS 696 N -0.46 -0.00 -1.09 9.51 -0.00 -1.16 -1.97 115.22 120.04 2o5j n HIS 696 Ca 0.20 0.01 0.04 0.00 -0.00 0.00 0.00 57.72 57.97 2o5j n HIS 696 Cb 0.25 -0.09 0.06 0.00 -0.00 0.00 0.00 29.99 30.20 2o5j n HIS 696 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2o5j n GLY 697 N -1.00 2.36 3.85 1.57 0.00 -1.26 -5.04 105.19 105.67 2o5j n GLY 697 Ca 0.00 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 2o5j n GLY 697 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j s LYS 698 N -1.38 3.87 0.20 1.61 -0.14 -0.83 -5.08 119.74 117.98 2o5j s LYS 698 Ca 0.13 0.88 0.07 0.00 -1.36 0.00 0.00 55.97 55.69 2o5j s LYS 698 Cb 0.12 -2.14 -0.05 0.00 -1.68 0.00 0.00 37.83 34.07 2o5j s LYS 698 CO 0.01 -0.31 -0.13 0.14 -0.76 0.00 0.00 175.35 174.30 2o5j s VAL 699 N -2.71 1.65 0.28 3.17 -7.23 -1.26 -4.38 120.40 109.91 2o5j s VAL 699 Ca 0.58 -2.19 0.08 0.00 -1.81 0.00 0.00 61.98 58.63 2o5j s VAL 699 Cb -0.10 -2.05 -0.06 0.00 0.56 0.00 0.00 36.38 34.73 2o5j s VAL 699 CO 0.36 -0.59 -0.09 0.68 -0.31 0.00 0.00 175.10 175.15 2o5j s VAL 700 N -3.03 1.81 -0.07 1.32 -7.23 -0.43 -4.33 120.40 108.44 2o5j s VAL 700 Ca 0.22 -2.17 -0.00 0.00 -1.81 0.00 0.00 61.98 58.22 2o5j s VAL 700 Cb 0.00 -2.41 -0.03 0.00 0.56 0.00 0.00 36.38 34.50 2o5j s VAL 700 CO 0.06 -0.34 -0.03 -0.76 -0.31 0.00 0.00 175.10 173.73 2o5j s LEU 701 N -3.45 3.38 -0.07 1.32 1.02 -0.62 -0.70 118.68 119.55 2o5j s LEU 701 Ca 0.29 0.05 0.02 0.00 0.02 0.00 0.00 54.13 54.50 2o5j s LEU 701 Cb 0.02 -1.78 -0.03 0.00 0.02 0.00 0.00 46.19 44.42 2o5j s LEU 701 CO 0.12 0.36 -0.11 -0.76 0.02 0.00 0.00 176.35 175.98 2o5j s LEU 702 N -0.94 2.90 0.12 1.79 1.02 -0.15 -0.59 118.68 122.83 2o5j s LEU 702 Ca 0.14 -0.16 0.08 0.00 0.02 0.00 0.00 54.13 54.21 2o5j s LEU 702 Cb -0.11 -1.62 -0.04 0.00 0.02 0.00 0.00 46.19 44.44 2o5j s LEU 702 CO 0.03 0.31 -0.19 0.21 0.02 0.00 0.00 176.35 176.73 2o5j s ASN 703 N -0.51 2.45 0.33 2.29 3.04 -0.63 -2.80 114.94 119.11 2o5j s ASN 703 Ca 0.07 -0.74 0.08 0.00 0.04 0.00 0.00 52.86 52.32 2o5j s ASN 703 Cb -0.12 -0.13 -0.04 0.00 -1.54 0.00 0.00 41.25 39.42 2o5j s ASN 703 CO 0.02 0.00 0.16 -0.60 -3.04 0.00 0.00 177.10 173.64 2o5j s ARG 704 N -2.19 2.43 0.00 0.43 6.06 -1.22 -1.01 118.95 123.45 2o5j s ARG 704 Ca 0.08 -1.49 0.00 0.00 -2.50 0.00 0.00 55.73 51.82 2o5j s ARG 704 Cb -0.08 -2.23 0.00 0.00 0.06 0.00 0.00 34.95 32.70 2o5j s ARG 704 CO 0.05 0.13 0.14 0.00 -2.50 0.00 0.00 175.30 173.12 2o5j n ALA 705 N -1.17 0.00 -2.59 6.12 0.00 -1.26 -3.92 120.51 117.69 2o5j n ALA 705 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.98 2o5j n ALA 705 Cb 0.61 0.03 -0.04 0.00 0.00 0.00 0.00 19.45 20.05 2o5j n ALA 705 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2o5j s PRO 706 N -0.28 3.75 -0.88 0.00 0.02 -1.26 -4.93 135.00 131.42 2o5j s PRO 706 Ca 0.00 0.38 -0.25 0.00 0.02 0.00 0.00 61.00 61.15 2o5j s PRO 706 Cb 0.00 -3.83 0.00 0.00 0.02 0.00 0.00 34.50 30.70 2o5j s PRO 706 CO 0.00 -0.94 1.66 0.99 -0.33 0.00 0.00 177.00 178.38 2o5j s THR 707 N 3.33 3.64 -0.10 0.99 2.01 -1.25 -4.79 115.64 119.46 2o5j s THR 707 Ca 0.35 -0.32 -0.16 0.00 0.31 0.00 0.00 61.69 61.86 2o5j s THR 707 Cb -0.12 -4.51 -0.27 0.00 0.01 0.00 0.00 72.50 67.61 2o5j s THR 707 CO 0.19 -1.43 0.57 -0.07 -0.69 0.00 0.00 174.62 173.19 2o5j h LEU 708 N 15.14 0.38 0.00 4.42 3.38 -1.92 -3.48 115.31 133.23 2o5j h LEU 708 Ca 0.03 -0.85 -0.61 0.00 0.09 0.00 0.00 57.88 56.54 2o5j h LEU 708 Cb 1.04 -0.12 -0.12 0.00 0.09 0.00 0.00 40.66 41.54 2o5j h LEU 708 CO 1.30 1.60 -0.45 0.00 0.09 0.00 0.00 178.44 180.98 2o5j n HIS 709 N -3.94 0.93 -0.25 1.13 1.44 -1.26 -4.42 115.22 108.84 2o5j n HIS 709 Ca -0.24 -2.40 0.04 0.00 -2.01 0.00 0.00 57.72 53.10 2o5j n HIS 709 Cb 0.89 -0.26 0.27 0.00 0.12 0.00 0.00 29.99 31.01 2o5j n HIS 709 CO 0.00 0.00 0.00 0.07 -2.81 0.00 0.00 176.34 173.60 2o5j h ARG 710 N 0.00 0.93 0.00 -1.40 0.11 -1.92 0.38 114.38 112.48 2o5j h ARG 710 Ca -0.38 -0.06 0.00 0.00 0.10 0.00 0.00 59.98 59.64 2o5j h ARG 710 Cb 1.20 -0.21 0.00 0.00 1.11 0.00 0.00 29.97 32.07 2o5j h ARG 710 CO 0.63 0.62 0.00 1.28 0.10 0.00 0.00 179.97 182.60 2o5j n LEU 711 N -4.47 0.00 0.14 0.08 4.77 -1.26 -2.09 117.00 114.17 2o5j n LEU 711 Ca 0.12 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.21 2o5j n LEU 711 Cb 0.16 0.00 0.52 0.00 -2.33 0.00 0.00 43.42 41.77 2o5j n LEU 711 CO 0.34 0.00 0.83 0.61 -1.33 0.00 0.00 177.39 177.84 2o5j n GLY 712 N -0.05 -1.05 2.84 -0.72 0.00 0.13 -4.30 105.19 102.05 2o5j n GLY 712 Ca 0.06 0.14 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 2o5j n GLY 712 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2o5j s ILE 713 N -3.42 -0.06 0.08 -0.61 1.01 -0.89 -3.39 121.20 113.92 2o5j s ILE 713 Ca 0.01 0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.89 2o5j s ILE 713 Cb 0.07 -0.17 -0.04 0.00 0.01 0.00 0.00 42.46 42.34 2o5j s ILE 713 CO 0.28 0.09 -0.07 -1.10 0.00 0.00 0.00 174.94 174.14 2o5j s GLN 714 N 1.19 0.75 -0.14 2.79 -0.21 -1.12 -4.94 119.66 117.97 2o5j s GLN 714 Ca -0.08 -1.17 -0.05 0.00 0.02 0.00 0.00 55.36 54.08 2o5j s GLN 714 Cb -0.12 -0.24 -0.04 0.00 1.00 0.00 0.00 33.01 33.61 2o5j s GLN 714 CO -0.05 0.00 0.04 0.00 -2.12 0.00 0.00 175.29 173.17 2o5j s ALA 715 N -2.96 3.40 0.17 6.09 0.00 -0.82 -0.98 121.76 126.66 2o5j s ALA 715 Ca 0.05 -0.75 0.01 0.00 0.00 0.00 0.00 51.96 51.28 2o5j s ALA 715 Cb 0.01 -1.75 -0.05 0.00 0.00 0.00 0.00 23.12 21.33 2o5j s ALA 715 CO -0.03 0.38 0.01 -0.06 0.00 0.00 0.00 175.76 176.05 2o5j s PHE 716 N -0.23 1.18 -0.32 0.00 0.40 0.12 -0.33 117.98 118.81 2o5j s PHE 716 Ca 0.07 -1.04 -0.21 0.00 -0.60 0.00 0.00 56.93 55.15 2o5j s PHE 716 Cb -0.12 -0.67 -0.01 0.00 0.51 0.00 0.00 43.02 42.73 2o5j s PHE 716 CO 0.02 -0.25 0.64 -1.14 0.70 0.00 0.00 175.22 175.19 2o5j s GLN 717 N -3.93 3.86 0.13 0.44 0.74 -0.36 -1.32 119.66 119.22 2o5j s GLN 717 Ca 0.24 0.27 -0.31 0.00 0.05 0.00 0.00 55.36 55.62 2o5j s GLN 717 Cb 0.06 -3.74 -0.08 0.00 1.10 0.00 0.00 33.01 30.35 2o5j s GLN 717 CO 0.04 -0.61 1.34 -2.14 -0.55 0.00 0.00 175.29 173.37 2o5j s PRO 718 N 2.66 4.36 -0.48 1.67 0.02 -1.26 -0.83 135.00 141.14 2o5j s PRO 718 Ca 0.26 2.03 -0.02 0.00 0.02 0.00 0.00 61.00 63.29 2o5j s PRO 718 Cb -0.15 -3.24 0.13 0.00 0.02 0.00 0.00 34.50 31.26 2o5j s PRO 718 CO 0.12 -0.36 0.27 0.08 -0.33 0.00 0.00 177.00 176.78 2o5j s VAL 719 N 0.80 3.27 -0.00 3.83 1.01 0.24 -4.91 120.40 124.63 2o5j s VAL 719 Ca 0.61 -2.46 -0.38 0.00 0.00 0.00 0.00 61.98 59.75 2o5j s VAL 719 Cb -0.36 -3.22 -0.17 0.00 0.00 0.00 0.00 36.38 32.63 2o5j s VAL 719 CO 0.32 -0.75 1.39 0.18 0.00 0.00 0.00 175.10 176.25 2o5j n LEU 720 N 4.10 1.60 -4.24 3.92 4.32 -1.25 -2.80 117.00 122.65 2o5j n LEU 720 Ca 0.02 1.12 -0.13 0.00 -0.02 0.00 0.00 56.01 56.99 2o5j n LEU 720 Cb 0.40 -1.15 -0.10 0.00 -1.62 0.00 0.00 43.42 40.95 2o5j n LEU 720 CO 0.32 -1.02 -0.35 -0.69 -1.22 0.00 0.00 177.39 174.44 2o5j s VAL 721 N 1.04 0.75 0.44 4.08 1.01 -0.68 -4.87 120.40 122.18 2o5j s VAL 721 Ca 0.88 -1.98 -0.17 0.00 0.00 0.00 0.00 61.98 60.71 2o5j s VAL 721 Cb -1.02 -2.03 -0.09 0.00 0.00 0.00 0.00 36.38 33.24 2o5j s VAL 721 CO 0.52 -0.56 0.90 -1.61 0.00 0.00 0.00 175.10 174.35 2o5j s GLU 722 N -3.88 4.01 0.00 2.72 2.02 -1.26 -1.05 118.70 121.26 2o5j s GLU 722 Ca 0.21 0.88 0.00 0.00 0.02 0.00 0.00 54.97 56.09 2o5j s GLU 722 Cb 0.06 -2.24 0.00 0.00 0.10 0.00 0.00 34.13 32.05 2o5j s GLU 722 CO 0.02 -0.09 0.00 0.41 0.02 0.00 0.00 175.26 175.62 2o5j n GLY 723 N -1.06 -1.74 0.13 -1.39 0.00 -1.26 -4.79 105.19 95.08 2o5j n GLY 723 Ca 0.06 -2.11 -0.21 0.00 0.00 0.00 0.00 46.02 43.75 2o5j n GLY 723 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o5j n GLN 724 N -0.03 0.68 -1.54 1.61 10.64 -1.26 -4.73 117.38 122.75 2o5j n GLN 724 Ca 0.00 0.27 -0.32 0.00 -1.83 0.00 0.00 57.00 55.12 2o5j n GLN 724 Cb 0.00 -1.63 0.06 0.00 -0.86 0.00 0.00 30.24 27.81 2o5j n GLN 724 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 2o5j s SER 725 N -6.90 5.00 -0.22 2.61 1.04 -1.26 -4.58 113.70 109.38 2o5j s SER 725 Ca -0.29 1.81 -0.05 0.00 0.48 0.00 0.00 55.95 57.91 2o5j s SER 725 Cb 0.08 -2.52 -0.01 0.00 0.10 0.00 0.00 66.02 63.66 2o5j s SER 725 CO 0.66 -1.70 -0.02 -0.63 0.98 0.00 0.00 173.24 172.53 2o5j s ILE 726 N -2.76 3.62 -0.29 -1.02 1.01 0.07 -4.29 121.20 117.53 2o5j s ILE 726 Ca 0.62 -0.41 -0.29 0.00 0.00 0.00 0.00 60.65 60.57 2o5j s ILE 726 Cb -0.17 -2.65 0.01 0.00 0.01 0.00 0.00 42.46 39.66 2o5j s ILE 726 CO 0.50 0.41 1.13 -1.10 0.00 0.00 0.00 174.94 175.89 2o5j s GLN 727 N 1.38 4.08 0.16 2.79 -0.21 0.73 -0.87 119.66 127.72 2o5j s GLN 727 Ca 0.05 1.19 0.05 0.00 0.02 0.00 0.00 55.36 56.67 2o5j s GLN 727 Cb -0.14 -3.75 -0.04 0.00 1.00 0.00 0.00 33.01 30.07 2o5j s GLN 727 CO -0.01 -0.89 0.13 -1.17 -2.12 0.00 0.00 175.29 171.23 2o5j s LEU 728 N 3.71 3.80 0.34 2.90 2.96 -0.72 0.10 118.68 131.78 2o5j s LEU 728 Ca 0.48 -0.12 -0.25 0.00 -0.22 0.00 0.00 54.13 54.02 2o5j s LEU 728 Cb -0.14 -2.42 -0.10 0.00 0.50 0.00 0.00 46.19 44.03 2o5j s LEU 728 CO 0.15 0.08 0.96 -2.28 -1.32 0.00 0.00 176.35 173.94 2o5j s HIS 729 N -1.72 3.60 0.13 5.38 5.65 -1.26 -1.18 115.29 125.89 2o5j s HIS 729 Ca 0.31 1.75 -0.14 0.00 0.25 0.00 0.00 55.06 57.23 2o5j s HIS 729 Cb -0.10 -2.94 -0.02 0.00 -1.18 0.00 0.00 32.58 28.34 2o5j s HIS 729 CO 0.23 0.08 1.54 -1.00 -0.65 0.00 0.00 174.74 174.94 2o5j h PRO 730 N 2.95 0.77 -0.35 2.88 0.13 -1.91 -3.20 132.00 133.27 2o5j h PRO 730 Ca -0.47 -0.29 0.04 0.00 -0.87 0.00 0.00 66.00 64.41 2o5j h PRO 730 Cb 1.19 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 2o5j h PRO 730 CO 0.64 0.90 0.24 -0.07 -0.23 0.00 0.00 178.00 179.48 2o5j h LEU 731 N 0.59 0.27 0.00 1.56 3.38 -1.93 -0.34 115.31 118.83 2o5j h LEU 731 Ca 0.10 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2o5j h LEU 731 Cb 0.61 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2o5j h LEU 731 CO 0.04 0.18 -0.10 1.33 0.09 0.00 0.00 178.44 179.98 2o5j n VAL 732 N -4.48 0.03 0.26 1.22 0.24 -1.21 -3.39 118.33 110.99 2o5j n VAL 732 Ca 0.04 -0.02 0.03 0.00 -2.04 0.00 0.00 64.34 62.35 2o5j n VAL 732 Cb 0.19 -0.37 0.14 0.00 -1.47 0.00 0.00 33.84 32.34 2o5j n VAL 732 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2o5j h GLU 734 N 0.00 0.05 0.00 0.00 5.08 -1.72 -3.24 114.58 114.75 2o5j h GLU 734 Ca 0.00 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2o5j h GLU 734 Cb 0.07 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2o5j h GLU 734 CO 0.00 1.04 0.00 0.00 -1.00 0.00 0.00 179.01 179.05 2o5j n ALA 735 N -2.97 -0.16 -2.31 3.43 0.00 -0.37 -3.96 120.51 114.18 2o5j n ALA 735 Ca -0.21 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.81 2o5j n ALA 735 Cb 0.64 0.28 -0.03 0.00 0.00 0.00 0.00 19.45 20.33 2o5j n ALA 735 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2o5j s PHE 736 N -2.60 3.12 -0.93 0.00 0.40 -1.02 -4.85 117.98 112.10 2o5j s PHE 736 Ca 0.00 1.04 -0.22 0.00 -0.60 0.00 0.00 56.93 57.14 2o5j s PHE 736 Cb 0.00 -3.56 -0.13 0.00 0.51 0.00 0.00 43.02 39.84 2o5j s PHE 736 CO 0.00 -1.92 1.92 -1.71 0.70 0.00 0.00 175.22 174.21 2o5j n ASN 737 N 4.78 2.75 -4.19 1.36 5.15 -1.25 -4.58 115.26 119.27 2o5j n ASN 737 Ca 0.11 -2.69 -0.21 0.00 -0.60 0.00 0.00 54.58 51.20 2o5j n ASN 737 Cb 0.45 -1.37 -0.13 0.00 -0.53 0.00 0.00 39.78 38.20 2o5j n ASN 737 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2o5j s ALA 738 N 7.52 1.37 -0.22 5.20 0.00 -1.22 -4.96 121.76 129.45 2o5j s ALA 738 Ca 0.62 -1.00 -0.09 0.00 0.00 0.00 0.00 51.96 51.49 2o5j s ALA 738 Cb 0.08 -0.18 0.09 0.00 0.00 0.00 0.00 23.12 23.11 2o5j s ALA 738 CO 0.13 0.25 0.48 0.16 0.00 0.00 0.00 175.76 176.77 2o5j s ASP 739 N -1.53 -0.51 -1.01 0.00 1.47 -1.26 -4.78 116.67 109.05 2o5j s ASP 739 Ca 0.02 1.11 -0.26 0.00 1.18 0.00 0.00 52.55 54.59 2o5j s ASP 739 Cb -0.09 1.40 -0.22 0.00 -0.34 0.00 0.00 42.92 43.67 2o5j s ASP 739 CO 0.02 -0.22 2.17 0.49 0.68 0.00 0.00 175.17 178.31 2o5j n PHE 740 N 5.09 0.95 -3.70 2.11 3.01 -1.26 -4.50 117.46 119.17 2o5j n PHE 740 Ca -0.13 -0.13 -0.11 0.00 1.01 0.00 0.00 57.45 58.10 2o5j n PHE 740 Cb 0.51 -2.59 -0.11 0.00 -0.01 0.00 0.00 39.48 37.28 2o5j n PHE 740 CO 0.00 0.00 0.00 0.16 1.01 0.00 0.00 176.76 177.93 2o5j s ASP 741 N 8.98 -0.39 0.00 4.37 -4.77 -1.26 -5.01 116.67 118.59 2o5j s ASP 741 Ca 0.84 0.81 0.00 0.00 -3.30 0.00 0.00 52.55 50.89 2o5j s ASP 741 Cb -0.07 0.75 0.00 0.00 -1.09 0.00 0.00 42.92 42.51 2o5j s ASP 741 CO 0.17 -0.19 0.00 0.61 0.70 0.00 0.00 175.17 176.45 2o5j n GLY 742 N 4.43 0.00 3.84 2.12 0.00 -1.26 -4.84 105.19 109.49 2o5j n GLY 742 Ca -0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 2o5j n GLY 742 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2o5j s ASP 743 N 0.00 6.26 0.01 1.61 -4.77 -1.26 -5.04 116.67 113.48 2o5j s ASP 743 Ca 0.00 1.58 0.02 0.00 -3.30 0.00 0.00 52.55 50.85 2o5j s ASP 743 Cb 0.00 -2.50 -0.01 0.00 -1.09 0.00 0.00 42.92 39.32 2o5j s ASP 743 CO 0.00 -0.84 -0.06 -1.10 0.70 0.00 0.00 175.17 173.87 2o5j s GLN 744 N -4.45 0.48 -0.05 2.11 -0.21 -1.26 -4.00 119.66 112.28 2o5j s GLN 744 Ca 0.59 -0.39 0.02 0.00 0.02 0.00 0.00 55.36 55.60 2o5j s GLN 744 Cb -0.12 -0.39 -0.03 0.00 1.00 0.00 0.00 33.01 33.48 2o5j s GLN 744 CO 0.40 0.10 -0.10 -1.64 -2.12 0.00 0.00 175.29 171.92 2o5j s MET 745 N -0.62 2.61 0.80 2.91 -1.94 -1.15 -4.40 119.30 117.50 2o5j s MET 745 Ca -0.02 -0.63 -0.09 0.00 -1.71 0.00 0.00 55.69 53.24 2o5j s MET 745 Cb -0.05 -2.48 0.12 0.00 2.01 0.00 0.00 34.83 34.43 2o5j s MET 745 CO 0.00 0.64 1.13 0.00 -0.01 0.00 0.00 175.02 176.78 2o5j s ALA 746 N -0.79 2.90 -0.14 3.03 0.00 -0.18 -3.25 121.76 123.33 2o5j s ALA 746 Ca 0.12 -1.11 -0.12 0.00 0.00 0.00 0.00 51.96 50.85 2o5j s ALA 746 Cb -0.11 -2.60 0.04 0.00 0.00 0.00 0.00 23.12 20.45 2o5j s ALA 746 CO 0.01 -1.73 0.37 0.54 0.00 0.00 0.00 175.76 174.95 2o5j s VAL 747 N -3.47 -0.01 0.30 0.00 0.11 0.29 -1.60 120.40 116.03 2o5j s VAL 747 Ca 0.66 0.03 0.04 0.00 -2.93 0.00 0.00 61.98 59.77 2o5j s VAL 747 Cb -0.08 -0.52 -0.06 0.00 -1.53 0.00 0.00 36.38 34.19 2o5j s VAL 747 CO 0.48 0.01 0.05 -1.00 -3.33 0.00 0.00 175.10 171.30 2o5j s HIS 748 N 0.49 1.88 -0.02 1.54 3.76 0.24 -0.42 115.29 122.76 2o5j s HIS 748 Ca -0.02 -0.96 0.01 0.00 -0.15 0.00 0.00 55.06 53.94 2o5j s HIS 748 Cb -0.04 -1.19 0.02 0.00 1.11 0.00 0.00 32.58 32.48 2o5j s HIS 748 CO -0.03 -0.01 -0.01 0.14 -0.85 0.00 0.00 174.74 173.98 2o5j s VAL 749 N -3.34 0.24 -0.21 -0.90 -7.23 -1.16 -1.59 120.40 106.22 2o5j s VAL 749 Ca 0.35 -0.00 -0.29 0.00 -1.81 0.00 0.00 61.98 60.23 2o5j s VAL 749 Cb 0.08 -0.29 -0.01 0.00 0.56 0.00 0.00 36.38 36.72 2o5j s VAL 749 CO 0.14 0.13 1.35 -2.84 -0.31 0.00 0.00 175.10 173.57 2o5j s PRO 750 N 0.70 4.07 -0.13 4.82 0.02 -1.26 -4.94 135.00 138.27 2o5j s PRO 750 Ca -0.07 1.57 -0.23 0.00 0.02 0.00 0.00 61.00 62.28 2o5j s PRO 750 Cb -0.10 -3.85 -0.26 0.00 0.02 0.00 0.00 34.50 30.31 2o5j s PRO 750 CO -0.01 -0.92 0.62 -0.07 -0.33 0.00 0.00 177.00 176.29 2o5j h LEU 751 N 10.37 0.16-10.26 -5.54 3.38 -1.97 -3.42 115.31 108.03 2o5j h LEU 751 Ca -0.28 -0.85 -0.50 0.00 0.09 0.00 0.00 57.88 56.34 2o5j h LEU 751 Cb 1.11 -0.05 0.06 0.00 0.09 0.00 0.00 40.66 41.88 2o5j h LEU 751 CO 0.99 1.31 0.38 -0.55 0.09 0.00 0.00 178.44 180.66 2o5j s SER 752 N -6.66 5.86 0.50 -0.43 0.15 -1.26 -4.91 113.70 106.95 2o5j s SER 752 Ca -0.21 1.66 0.23 0.00 0.70 0.00 0.00 55.95 58.33 2o5j s SER 752 Cb 0.01 -2.51 1.30 0.00 -1.71 0.00 0.00 66.02 63.12 2o5j s SER 752 CO 0.71 -1.11 2.05 0.28 1.20 0.00 0.00 173.24 176.36 2o5j h SER 753 N 0.07 0.00 0.43 5.45 0.02 -1.99 -1.50 113.55 116.03 2o5j h SER 753 Ca -0.46 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.47 2o5j h SER 753 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2o5j h SER 753 CO 0.58 0.14 -0.21 -0.26 -1.14 0.00 0.00 176.83 175.95 2o5j h PHE 754 N 0.00 -0.54 -0.96 3.45 -1.00 -1.98 -1.21 116.94 114.71 2o5j h PHE 754 Ca -0.00 -0.01 0.14 0.00 2.81 0.00 0.00 57.97 60.90 2o5j h PHE 754 Cb 0.32 0.18 -0.09 0.00 3.61 0.00 0.00 35.95 39.97 2o5j h PHE 754 CO 0.00 -0.22 0.58 0.00 -1.61 0.00 0.00 178.31 177.06 2o5j h ALA 755 N -0.73 1.48 0.11 2.45 0.00 -1.88 -0.45 119.26 120.24 2o5j h ALA 755 Ca -0.06 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2o5j h ALA 755 Cb 0.56 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2o5j h ALA 755 CO 0.10 0.10 -0.13 0.37 0.00 0.00 0.00 179.25 179.68 2o5j h GLN 756 N 0.86 -0.27 0.02 0.00 5.75 -1.29 0.12 115.11 120.30 2o5j h GLN 756 Ca 0.50 0.02 0.02 0.00 -0.15 0.00 0.00 58.65 59.03 2o5j h GLN 756 Cb 0.60 0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.17 2o5j h GLN 756 CO -0.31 -0.18 -0.43 0.00 -2.65 0.00 0.00 178.83 175.26 2o5j h ALA 757 N 0.58 -0.88 -0.24 3.38 0.00 0.15 -0.99 119.26 121.26 2o5j h ALA 757 Ca 0.01 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.89 2o5j h ALA 757 Cb 0.28 0.86 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 2o5j h ALA 757 CO -0.05 -1.00 0.00 1.05 0.00 0.00 0.00 179.25 179.25 2o5j h GLU 758 N -0.56 0.07 -0.84 0.00 4.11 -1.15 -0.28 114.58 115.93 2o5j h GLU 758 Ca 0.01 -0.00 0.14 0.00 0.07 0.00 0.00 59.36 59.57 2o5j h GLU 758 Cb 0.59 -0.02 -0.09 0.00 0.50 0.00 0.00 28.75 29.73 2o5j h GLU 758 CO -0.28 0.05 0.43 0.00 0.07 0.00 0.00 179.01 179.29 2o5j h ALA 759 N 1.21 1.25 0.00 1.06 0.00 -0.50 0.93 119.26 123.21 2o5j h ALA 759 Ca 0.12 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2o5j h ALA 759 Cb 0.15 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2o5j h ALA 759 CO -0.19 -0.07 -0.98 2.89 0.00 0.00 0.00 179.25 180.90 2o5j n ARG 760 N -4.86 0.50 -0.05 0.00 1.85 -0.40 -0.66 116.66 113.05 2o5j n ARG 760 Ca 0.16 0.08 -0.22 0.00 -1.00 0.00 0.00 57.85 56.88 2o5j n ARG 760 Cb 0.41 -1.75 -0.13 0.00 -1.05 0.00 0.00 32.46 29.94 2o5j n ARG 760 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 2o5j n ILE 761 N -2.44 1.67 -0.00 8.89 5.41 -0.16 -4.35 119.36 128.38 2o5j n ILE 761 Ca 0.01 -0.49 0.00 0.00 1.00 0.00 0.00 62.75 63.27 2o5j n ILE 761 Cb 0.51 -1.77 0.00 0.00 -0.71 0.00 0.00 39.64 37.67 2o5j n ILE 761 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2o5j n GLN 762 N -3.71 2.31 -0.01 0.38 10.64 0.28 -4.73 117.38 122.54 2o5j n GLN 762 Ca -0.36 -0.29 0.01 0.00 -1.83 0.00 0.00 57.00 54.54 2o5j n GLN 762 Cb 0.95 -0.79 -0.04 0.00 -0.86 0.00 0.00 30.24 29.50 2o5j n GLN 762 CO 0.00 0.00 0.00 -0.12 -1.83 0.00 0.00 177.06 175.11 2o5j n MET 763 N -0.41 0.87 -1.58 2.61 1.56 -1.00 -4.82 117.12 114.34 2o5j n MET 763 Ca 0.00 -0.03 -0.45 0.00 -0.27 0.00 0.00 57.70 56.95 2o5j n MET 763 Cb 0.00 -1.11 -0.02 0.00 2.15 0.00 0.00 33.22 34.24 2o5j n MET 763 CO 0.00 0.00 0.00 -0.11 -0.73 0.00 0.00 175.97 175.13 2o5j n LEU 764 N -1.78 1.58 -0.09 -0.89 7.94 0.17 -1.95 117.00 121.97 2o5j n LEU 764 Ca -0.02 1.17 -0.05 0.00 -1.11 0.00 0.00 56.01 56.00 2o5j n LEU 764 Cb 0.24 -1.26 -0.04 0.00 0.53 0.00 0.00 43.42 42.89 2o5j n LEU 764 CO 0.10 -1.50 0.50 0.77 -1.11 0.00 0.00 177.39 176.14 2o5j h SER 765 N 1.97 -0.83 0.00 1.96 4.64 -0.96 0.16 113.55 120.49 2o5j h SER 765 Ca -0.39 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2o5j h SER 765 Cb 1.35 0.35 0.00 0.00 -0.31 0.00 0.00 62.40 63.78 2o5j h SER 765 CO 0.61 -0.15 0.34 0.00 -0.87 0.00 0.00 176.83 176.76 2o5j h ALA 766 N -0.65 1.31 0.00 5.18 0.00 -1.82 0.97 119.26 124.26 2o5j h ALA 766 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2o5j h ALA 766 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2o5j h ALA 766 CO -0.30 -0.31 -0.62 0.45 0.00 0.00 0.00 179.25 178.48 2o5j h HIS 767 N 0.00 0.00 -2.80 0.00 3.86 -1.01 -3.39 115.15 111.80 2o5j h HIS 767 Ca 0.00 0.00 -0.70 0.00 -1.16 0.00 0.00 60.37 58.51 2o5j h HIS 767 Cb 0.69 0.00 -0.35 0.00 1.06 0.00 0.00 27.41 28.81 2o5j h HIS 767 CO 0.00 0.00 0.04 0.09 0.86 0.00 0.00 177.93 178.92 2o5j n ASN 768 N -2.82 4.81 0.04 2.45 3.02 0.34 -4.75 115.26 118.35 2o5j n ASN 768 Ca 0.02 -3.33 -0.21 0.00 -0.03 0.00 0.00 54.58 51.02 2o5j n ASN 768 Cb 0.54 -1.00 -0.14 0.00 -0.61 0.00 0.00 39.78 38.57 2o5j n ASN 768 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2o5j h LEU 769 N 5.19 0.47-10.07 3.41 3.38 -1.76 -3.46 115.31 112.47 2o5j h LEU 769 Ca 0.19 -0.91 -0.50 0.00 0.09 0.00 0.00 57.88 56.75 2o5j h LEU 769 Cb 0.69 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2o5j h LEU 769 CO 1.01 1.54 0.08 -0.76 0.09 0.00 0.00 178.44 180.40 2o5j s LEU 770 N -7.69 3.98 0.36 1.67 1.43 -1.25 -1.91 118.68 115.28 2o5j s LEU 770 Ca -0.16 1.17 -0.11 0.00 -1.03 0.00 0.00 54.13 54.00 2o5j s LEU 770 Cb 0.03 -4.00 -0.07 0.00 0.03 0.00 0.00 46.19 42.18 2o5j s LEU 770 CO 0.81 -0.27 0.73 -0.94 0.23 0.00 0.00 176.35 176.91 2o5j s SER 771 N -2.64 6.58 0.36 2.29 1.04 -1.18 -4.84 113.70 115.31 2o5j s SER 771 Ca 0.52 1.11 0.18 0.00 0.48 0.00 0.00 55.95 58.24 2o5j s SER 771 Cb -0.10 -2.31 0.58 0.00 0.10 0.00 0.00 66.02 64.29 2o5j s SER 771 CO 0.23 -0.31 1.69 -0.65 0.98 0.00 0.00 173.24 175.18 2o5j h PRO 772 N 1.63 0.00 0.41 4.02 0.11 -1.92 -3.32 132.00 132.92 2o5j h PRO 772 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2o5j h PRO 772 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2o5j h PRO 772 CO 0.65 0.41 -0.20 0.00 -0.21 0.00 0.00 178.00 178.65 2o5j h ALA 773 N 1.59 -0.68 -2.42 -0.75 0.00 -1.91 -3.46 119.26 111.63 2o5j h ALA 773 Ca -0.00 -0.12 -0.61 0.00 0.00 0.00 0.00 54.91 54.18 2o5j h ALA 773 Cb 0.98 0.21 -0.14 0.00 0.00 0.00 0.00 17.79 18.84 2o5j h ALA 773 CO 0.05 -0.64 -0.75 -1.54 0.00 0.00 0.00 179.25 176.38 2o5j s SER 774 N -4.16 3.79 0.00 0.00 1.04 -1.23 -0.81 113.70 112.34 2o5j s SER 774 Ca -0.08 -0.90 0.01 0.00 0.48 0.00 0.00 55.95 55.46 2o5j s SER 774 Cb 0.01 -0.42 0.06 0.00 0.10 0.00 0.00 66.02 65.76 2o5j s SER 774 CO 0.24 0.05 0.84 0.61 0.98 0.00 0.00 173.24 175.96 2o5j n GLY 775 N -0.49 -0.80 3.81 7.32 0.00 -1.26 -3.53 105.19 110.24 2o5j n GLY 775 Ca -0.07 -0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 2o5j n GLY 775 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o5j s GLU 776 N -2.00 4.31 0.81 1.61 0.41 -1.26 -4.85 118.70 117.73 2o5j s GLU 776 Ca 0.02 0.95 -0.13 0.00 -0.41 0.00 0.00 54.97 55.40 2o5j s GLU 776 Cb 0.01 -2.85 0.09 0.00 -1.78 0.00 0.00 34.13 29.60 2o5j s GLU 776 CO 0.01 0.36 1.20 -2.14 -0.49 0.00 0.00 175.26 174.20 2o5j s PRO 777 N -2.02 1.61 0.00 0.39 0.02 -1.26 -3.09 135.00 130.64 2o5j s PRO 777 Ca 0.45 1.72 0.00 0.00 0.02 0.00 0.00 61.00 63.19 2o5j s PRO 777 Cb -0.17 -1.78 -0.00 0.00 0.02 0.00 0.00 34.50 32.57 2o5j s PRO 777 CO 0.21 -2.23 0.13 -0.11 -0.33 0.00 0.00 177.00 174.67 2o5j n LEU 778 N -3.37 0.24 -1.82 -5.54 7.94 -0.80 -4.60 117.00 109.06 2o5j n LEU 778 Ca 0.13 -0.62 -0.16 0.00 -1.11 0.00 0.00 56.01 54.25 2o5j n LEU 778 Cb 0.51 0.00 0.08 0.00 0.53 0.00 0.00 43.42 44.54 2o5j n LEU 778 CO 0.48 0.06 1.08 0.00 -1.11 0.00 0.00 177.39 177.90 2o5j n ALA 779 N -0.77 4.72 -1.99 1.96 0.00 -1.25 -4.29 120.51 118.88 2o5j n ALA 779 Ca 0.00 -1.81 -0.41 0.00 0.00 0.00 0.00 53.44 51.22 2o5j n ALA 779 Cb 0.00 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.09 2o5j n ALA 779 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2o5j s LYS 780 N -2.03 4.43 0.20 0.00 1.02 -1.26 -4.93 119.74 117.16 2o5j s LYS 780 Ca 0.35 2.00 -0.33 0.00 0.02 0.00 0.00 55.97 58.01 2o5j s LYS 780 Cb 0.28 -3.20 -0.14 0.00 -0.52 0.00 0.00 37.83 34.26 2o5j s LYS 780 CO 0.04 -0.18 1.49 -2.30 -0.92 0.00 0.00 175.35 173.48 2o5j n PRO 781 N 2.39 2.08 -0.17 -1.68 -0.02 -1.26 -4.95 135.00 131.40 2o5j n PRO 781 Ca 0.05 0.75 -0.02 0.00 -2.02 0.00 0.00 63.50 62.25 2o5j n PRO 781 Cb 0.43 -2.46 0.02 0.00 -0.02 0.00 0.00 33.50 31.47 2o5j n PRO 781 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2o5j n SER 782 N 2.79 0.01 -0.24 2.55 3.41 -1.26 -4.61 113.62 116.27 2o5j n SER 782 Ca 0.14 -1.04 0.04 0.00 -0.26 0.00 0.00 58.87 57.75 2o5j n SER 782 Cb 0.30 -0.08 0.13 0.00 -0.26 0.00 0.00 64.21 64.31 2o5j n SER 782 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2o5j h ARG 783 N 0.00 0.09 0.65 4.33 2.47 -1.78 -1.54 114.38 118.61 2o5j h ARG 783 Ca -0.03 -0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.65 2o5j h ARG 783 Cb 0.09 -0.02 0.01 0.00 -1.65 0.00 0.00 29.97 28.40 2o5j h ARG 783 CO 0.02 0.06 -0.31 -0.44 0.56 0.00 0.00 179.97 179.86 2o5j h ASP 784 N 0.09 -0.74 -0.54 7.04 3.32 -1.92 -3.02 116.42 120.64 2o5j h ASP 784 Ca 0.38 0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.49 2o5j h ASP 784 Cb 0.65 0.19 -0.05 0.00 0.22 0.00 0.00 39.33 40.34 2o5j h ASP 784 CO -0.64 -0.37 0.27 0.40 -1.72 0.00 0.00 179.24 177.18 2o5j h ILE 785 N -1.18 0.94 -0.67 0.35 5.03 -1.78 -2.87 117.51 117.32 2o5j h ILE 785 Ca -0.09 -0.18 0.03 0.00 -0.12 0.00 0.00 64.86 64.50 2o5j h ILE 785 Cb 0.70 0.37 -0.04 0.00 -3.03 0.00 0.00 36.82 34.82 2o5j h ILE 785 CO 0.15 0.09 0.42 0.40 -0.68 0.00 0.00 178.15 178.54 2o5j h ILE 786 N 0.52 1.10 -0.80 -0.67 2.04 -1.37 -1.30 117.51 117.03 2o5j h ILE 786 Ca 0.24 -0.29 0.05 0.00 1.00 0.00 0.00 64.86 65.86 2o5j h ILE 786 Cb 0.17 0.19 -0.05 0.00 -0.74 0.00 0.00 36.82 36.39 2o5j h ILE 786 CO -0.18 0.15 0.53 0.25 0.00 0.00 0.00 178.15 178.90 2o5j h LEU 787 N 0.84 0.82 0.01 1.44 5.85 -1.37 0.40 115.31 123.29 2o5j h LEU 787 Ca 0.27 -0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.88 2o5j h LEU 787 Cb -0.00 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 40.86 2o5j h LEU 787 CO -0.10 0.55 -0.41 1.23 -0.34 0.00 0.00 178.44 179.37 2o5j h GLY 788 N 0.94 0.30 2.00 3.75 0.00 -1.20 -3.02 103.07 105.84 2o5j h GLY 788 Ca 0.33 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 2o5j h GLY 788 CO -0.11 0.47 -0.03 1.41 0.00 0.00 0.00 176.54 178.28 2o5j h LEU 789 N -0.35 0.00 0.16 3.11 3.38 -1.12 -3.11 115.31 117.39 2o5j h LEU 789 Ca -0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2o5j h LEU 789 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2o5j h LEU 789 CO 0.08 0.03 -0.08 0.22 0.09 0.00 0.00 178.44 178.79 2o5j h TYR 790 N 0.00 -0.20 -0.98 1.13 5.03 -0.99 -3.31 116.97 117.65 2o5j h TYR 790 Ca -0.00 -0.00 0.28 0.00 2.58 0.00 0.00 58.73 61.58 2o5j h TYR 790 Cb 0.55 0.07 -0.18 0.00 1.55 0.00 0.00 36.73 38.71 2o5j h TYR 790 CO 0.00 -0.12 0.04 0.98 -1.32 0.00 0.00 178.16 177.74 2o5j n TYR 791 N -4.27 0.65 0.21 -3.82 9.36 -1.14 -0.21 117.16 117.94 2o5j n TYR 791 Ca -0.03 1.18 0.06 0.00 3.32 0.00 0.00 57.90 62.43 2o5j n TYR 791 Cb 0.08 -1.25 0.46 0.00 -0.63 0.00 0.00 39.34 38.00 2o5j n TYR 791 CO 0.00 0.00 0.00 0.97 0.22 0.00 0.00 176.86 178.05 2o5j h ILE 792 N 0.00 1.04 -0.01 2.97 2.10 -1.69 -3.18 117.51 118.74 2o5j h ILE 792 Ca 0.60 -1.06 0.00 0.00 1.08 0.00 0.00 64.86 65.49 2o5j h ILE 792 Cb 1.26 1.60 0.00 0.00 -1.09 0.00 0.00 36.82 38.59 2o5j h ILE 792 CO -0.92 0.29 -0.48 0.35 -1.08 0.00 0.00 178.15 176.31 2o5j n THR 793 N -3.95 0.00 -2.76 2.19 -2.24 0.71 -3.80 114.28 104.44 2o5j n THR 793 Ca -0.02 -0.26 -0.36 0.00 -2.27 0.00 0.00 64.05 61.14 2o5j n THR 793 Cb 0.36 1.24 -0.06 0.00 -2.10 0.00 0.00 70.33 69.77 2o5j n THR 793 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2o5j s GLN 794 N -2.42 4.47 -0.06 -0.78 2.00 -0.98 -4.58 119.66 117.31 2o5j s GLN 794 Ca 0.17 1.32 -0.04 0.00 -2.00 0.00 0.00 55.36 54.81 2o5j s GLN 794 Cb 0.17 -2.66 -0.04 0.00 0.80 0.00 0.00 33.01 31.28 2o5j s GLN 794 CO 0.56 0.18 0.14 0.08 -0.50 0.00 0.00 175.29 175.75 2o5j s VAL 795 N -1.72 5.32 0.16 1.34 1.01 -1.26 -4.32 120.40 120.94 2o5j s VAL 795 Ca 0.53 -0.04 0.05 0.00 0.00 0.00 0.00 61.98 62.52 2o5j s VAL 795 Cb -0.17 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 2o5j s VAL 795 CO 0.22 0.47 0.15 -0.13 0.00 0.00 0.00 175.10 175.80 2o5j s ARG 796 N -1.48 2.93 -0.00 2.72 0.52 -0.87 -5.04 118.95 117.73 2o5j s ARG 796 Ca 0.21 -0.85 0.04 0.00 -0.52 0.00 0.00 55.73 54.61 2o5j s ARG 796 Cb -0.12 -2.66 -0.01 0.00 0.52 0.00 0.00 34.95 32.67 2o5j s ARG 796 CO 0.11 0.49 -0.13 0.15 0.02 0.00 0.00 175.30 175.94 2o5j s LYS 797 N -3.11 1.02 0.08 3.54 3.01 -1.26 -4.80 119.74 118.21 2o5j s LYS 797 Ca 0.31 -0.50 0.00 0.00 -1.01 0.00 0.00 55.97 54.77 2o5j s LYS 797 Cb -0.10 -0.99 0.00 0.00 -1.01 0.00 0.00 37.83 35.73 2o5j s LYS 797 CO 0.24 0.27 0.00 -1.91 0.51 0.00 0.00 175.35 174.45 2o5j n GLU 798 N 2.63 0.00 -3.71 1.68 2.13 -0.57 -5.06 120.64 117.75 2o5j n GLU 798 Ca -0.15 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.56 2o5j n GLU 798 Cb 0.55 -0.05 -0.11 0.00 0.27 0.00 0.00 31.44 32.11 2o5j n GLU 798 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2o5j s LYS 799 N -1.32 0.39 -0.34 5.31 2.20 -1.26 -5.07 119.74 119.64 2o5j s LYS 799 Ca 0.00 0.73 0.00 0.00 -0.36 0.00 0.00 55.97 56.34 2o5j s LYS 799 Cb 0.00 0.01 0.11 0.00 -1.51 0.00 0.00 37.83 36.43 2o5j s LYS 799 CO 0.00 -0.14 0.12 0.21 -0.36 0.00 0.00 175.35 175.18 2o5j s LYS 800 N 1.20 0.92 -0.14 4.03 2.36 -1.26 -3.93 119.74 122.91 2o5j s LYS 800 Ca -0.08 -1.36 -0.02 0.00 -2.55 0.00 0.00 55.97 51.96 2o5j s LYS 800 Cb -0.08 -2.20 -0.08 0.00 -1.05 0.00 0.00 37.83 34.43 2o5j s LYS 800 CO -0.10 -1.02 -0.14 0.41 1.55 0.00 0.00 175.35 176.05 2o5j n GLY 801 N 4.50 -0.20 3.81 5.54 0.00 -1.26 -5.02 105.19 112.56 2o5j n GLY 801 Ca 0.01 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 2o5j n GLY 801 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j s ALA 802 N -2.27 3.67 0.00 4.61 0.00 -1.26 -5.03 121.76 121.48 2o5j s ALA 802 Ca -0.19 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 50.79 2o5j s ALA 802 Cb 0.06 -1.53 0.00 0.00 0.00 0.00 0.00 23.12 21.65 2o5j s ALA 802 CO 0.29 0.75 0.00 0.41 0.00 0.00 0.00 175.76 177.22 2o5j n GLY 803 N 0.37 0.00 0.03 0.00 0.00 -1.26 -4.94 105.19 99.39 2o5j n GLY 803 Ca -0.08 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.99 2o5j n GLY 803 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2o5j n LEU 804 N 0.00 2.15 -3.32 0.99 -0.00 -1.26 -4.91 117.00 110.65 2o5j n LEU 804 Ca 0.00 -2.47 -0.40 0.00 -0.00 0.00 0.00 56.01 53.14 2o5j n LEU 804 Cb 0.00 -0.19 0.02 0.00 -0.00 0.00 0.00 43.42 43.26 2o5j n LEU 804 CO 0.00 0.59 1.54 -0.62 -0.00 0.00 0.00 177.39 178.90 2o5j n GLU 805 N -0.90 4.29 0.26 1.47 1.02 -1.26 -3.97 120.64 121.55 2o5j n GLU 805 Ca 0.07 -4.09 0.13 0.00 -0.02 0.00 0.00 57.16 53.25 2o5j n GLU 805 Cb 0.42 -2.39 0.73 0.00 -0.02 0.00 0.00 31.44 30.18 2o5j n GLU 805 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 2o5j h PHE 806 N 3.74 0.00 -0.90 -0.32 3.57 -1.87 -3.22 116.94 117.94 2o5j h PHE 806 Ca 0.55 0.00 0.32 0.00 3.53 0.00 0.00 57.97 62.37 2o5j h PHE 806 Cb 0.22 0.00 -0.10 0.00 2.79 0.00 0.00 35.95 38.86 2o5j h PHE 806 CO 1.30 0.11 0.56 0.00 -2.23 0.00 0.00 178.31 178.05 2o5j n ALA 807 N -2.29 0.89 0.02 2.41 0.00 -1.26 -3.64 120.51 116.63 2o5j n ALA 807 Ca -0.02 0.62 -0.02 0.00 0.00 0.00 0.00 53.44 54.02 2o5j n ALA 807 Cb 0.23 -0.72 -0.01 0.00 0.00 0.00 0.00 19.45 18.95 2o5j n ALA 807 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2o5j n THR 808 N -4.15 1.12 -2.20 0.00 -2.24 -1.22 -5.06 114.28 100.53 2o5j n THR 808 Ca 0.27 0.32 -0.36 0.00 -2.27 0.00 0.00 64.05 62.01 2o5j n THR 808 Cb 1.04 -1.68 0.00 0.00 -2.10 0.00 0.00 70.33 67.60 2o5j n THR 808 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2o5j s PRO 809 N -2.04 3.50 0.09 -0.78 0.02 -1.24 -4.92 135.00 129.63 2o5j s PRO 809 Ca -0.06 1.75 0.24 0.00 0.02 0.00 0.00 61.00 62.96 2o5j s PRO 809 Cb 0.01 -2.21 0.39 0.00 0.02 0.00 0.00 34.50 32.71 2o5j s PRO 809 CO 0.09 -0.76 1.35 0.39 -0.33 0.00 0.00 177.00 177.73 2o5j n GLU 810 N -0.92 0.23 0.11 5.54 4.71 -1.26 -3.04 120.64 126.01 2o5j n GLU 810 Ca 0.10 0.06 0.08 0.00 -0.01 0.00 0.00 57.16 57.39 2o5j n GLU 810 Cb 0.49 -1.64 0.01 0.00 -1.01 0.00 0.00 31.44 29.29 2o5j n GLU 810 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 2o5j h GLU 811 N 0.00 0.00 -0.04 3.49 4.57 -1.97 -3.13 114.58 117.50 2o5j h GLU 811 Ca 0.00 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.07 2o5j h GLU 811 Cb 0.69 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 2o5j h GLU 811 CO 0.00 0.13 -0.49 0.00 -1.18 0.00 0.00 179.01 177.47 2o5j h ALA 812 N 1.79 1.11 0.07 2.92 0.00 -1.89 0.47 119.26 123.73 2o5j h ALA 812 Ca -0.04 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 2o5j h ALA 812 Cb 1.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2o5j h ALA 812 CO 0.02 0.63 -0.04 1.37 0.00 0.00 0.00 179.25 181.23 2o5j h LEU 813 N 0.08 -0.08 0.75 0.00 8.10 -1.54 -2.74 115.31 119.89 2o5j h LEU 813 Ca 0.00 -0.49 -0.04 0.00 0.11 0.00 0.00 57.88 57.47 2o5j h LEU 813 Cb 0.90 0.02 0.01 0.00 -0.44 0.00 0.00 40.66 41.15 2o5j h LEU 813 CO 0.07 0.49 -0.36 0.00 -4.11 0.00 0.00 178.44 174.52 2o5j h ALA 814 N 0.12 -1.18 -0.36 0.17 0.00 -1.54 -2.07 119.26 114.39 2o5j h ALA 814 Ca -0.01 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 54.76 2o5j h ALA 814 Cb 0.57 0.39 -0.08 0.00 0.00 0.00 0.00 17.79 18.66 2o5j h ALA 814 CO 0.02 -1.11 -0.25 0.00 0.00 0.00 0.00 179.25 177.91 2o5j h ALA 815 N -1.46 -0.05 -0.00 0.00 0.00 -1.05 0.58 119.26 117.28 2o5j h ALA 815 Ca -0.10 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2o5j h ALA 815 Cb 0.78 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2o5j h ALA 815 CO 0.17 -0.64 0.00 0.72 0.00 0.00 0.00 179.25 179.50 2o5j n HIS 816 N -5.39 0.00 -0.01 0.00 8.25 -1.03 -0.32 115.22 116.72 2o5j n HIS 816 Ca 0.01 -0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.35 2o5j n HIS 816 Cb 0.31 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.28 2o5j n HIS 816 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2o5j h GLU 817 N 0.35 0.07 0.10 -0.41 4.81 -0.19 -3.10 114.58 116.22 2o5j h GLU 817 Ca 0.00 -0.12 -0.30 0.00 -0.13 0.00 0.00 59.36 58.81 2o5j h GLU 817 Cb 0.08 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 2o5j h GLU 817 CO 0.00 0.69 -1.54 0.00 -0.73 0.00 0.00 179.01 177.43 2o5j h ARG 818 N 0.02 0.21 -0.21 1.92 3.08 -0.98 -2.82 114.38 115.60 2o5j h ARG 818 Ca -0.31 -0.35 -0.03 0.00 0.07 0.00 0.00 59.98 59.36 2o5j h ARG 818 Cb 2.01 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 32.18 2o5j h ARG 818 CO 0.09 1.04 0.00 0.78 -1.07 0.00 0.00 179.97 180.81 2o5j h GLY 819 N 1.93 0.33 0.71 0.04 0.00 -0.82 0.18 103.07 105.44 2o5j h GLY 819 Ca -0.24 -0.17 -0.09 0.00 0.00 0.00 0.00 47.33 46.83 2o5j h GLY 819 CO 0.15 0.16 -0.29 -2.09 0.00 0.00 0.00 176.54 174.47 2o5j h GLU 820 N 0.31 0.36 -0.70 4.80 4.22 -1.60 -2.43 114.58 119.52 2o5j h GLU 820 Ca 0.07 -0.26 0.13 0.00 0.08 0.00 0.00 59.36 59.38 2o5j h GLU 820 Cb 0.21 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 2o5j h GLU 820 CO 0.00 0.88 0.47 0.28 -2.18 0.00 0.00 179.01 178.47 2o5j h VAL 821 N -0.10 0.83 0.00 0.32 2.07 -1.13 -3.39 116.25 114.84 2o5j h VAL 821 Ca -0.01 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2o5j h VAL 821 Cb 0.91 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 2o5j h VAL 821 CO 0.06 0.07 0.00 0.00 0.02 0.00 0.00 177.57 177.73 2o5j n ALA 822 N -2.52 0.00 0.21 1.67 0.00 0.56 -5.01 120.51 115.43 2o5j n ALA 822 Ca 0.13 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.59 2o5j n ALA 822 Cb 0.48 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.91 2o5j n ALA 822 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2o5j n LEU 823 N 0.00 0.46 0.30 0.00 0.00 -1.21 -4.79 117.00 111.76 2o5j n LEU 823 Ca 0.00 -0.60 -0.15 0.00 0.00 0.00 0.00 56.01 55.26 2o5j n LEU 823 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 43.42 43.34 2o5j n LEU 823 CO 0.00 0.10 0.51 0.78 0.00 0.00 0.00 177.39 178.78 2o5j h ASN 824 N 0.20 -0.65 -3.65 1.96 -0.26 -1.77 -3.44 115.58 107.97 2o5j h ASN 824 Ca 0.00 -0.04 -0.65 0.00 -0.56 0.00 0.00 56.30 55.05 2o5j h ASN 824 Cb 0.13 0.17 -0.21 0.00 -1.06 0.00 0.00 38.32 37.34 2o5j h ASN 824 CO 0.00 -0.32 -0.61 0.00 -1.06 0.00 0.00 177.43 175.44 2o5j s ALA 825 N -5.22 3.23 1.06 -0.83 0.00 -0.94 -4.65 121.76 114.40 2o5j s ALA 825 Ca -0.15 -1.10 -0.14 0.00 0.00 0.00 0.00 51.96 50.57 2o5j s ALA 825 Cb 0.02 -2.12 0.22 0.00 0.00 0.00 0.00 23.12 21.24 2o5j s ALA 825 CO 0.52 -0.45 1.09 -2.14 0.00 0.00 0.00 175.76 174.78 2o5j s PRO 826 N 1.54 -0.06 0.15 0.00 0.02 -1.25 -3.88 135.00 131.53 2o5j s PRO 826 Ca 0.06 0.40 0.25 0.00 0.02 0.00 0.00 61.00 61.73 2o5j s PRO 826 Cb -0.15 -1.69 0.93 0.00 0.02 0.00 0.00 34.50 33.60 2o5j s PRO 826 CO 0.05 -3.03 1.77 -0.89 -0.33 0.00 0.00 177.00 174.56 2o5j n ILE 827 N -4.37 0.54 -3.45 2.83 -0.00 -1.26 -4.01 119.36 109.65 2o5j n ILE 827 Ca 0.06 -0.07 -0.26 0.00 -0.00 0.00 0.00 62.75 62.48 2o5j n ILE 827 Cb 0.58 -0.72 -0.09 0.00 -0.00 0.00 0.00 39.64 39.40 2o5j n ILE 827 CO 0.00 0.00 0.00 2.29 -0.00 0.00 0.00 176.55 178.84 2o5j n LYS 828 N -2.02 1.00 -4.30 0.38 2.85 -1.26 -1.34 118.16 113.47 2o5j n LYS 828 Ca 0.05 -3.67 -0.35 0.00 -1.05 0.00 0.00 58.31 53.29 2o5j n LYS 828 Cb 0.35 -1.76 -0.09 0.00 -0.65 0.00 0.00 35.03 32.87 2o5j n LYS 828 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2o5j s VAL 829 N -0.94 4.44 -0.81 0.58 1.01 -1.26 -1.51 120.40 121.91 2o5j s VAL 829 Ca 0.33 -0.19 -0.26 0.00 0.00 0.00 0.00 61.98 61.86 2o5j s VAL 829 Cb 0.07 -2.89 -0.12 0.00 0.00 0.00 0.00 36.38 33.44 2o5j s VAL 829 CO -0.14 0.59 2.32 0.00 0.00 0.00 0.00 175.10 177.86 2o5j s ALA 830 N -0.71 0.87 -0.35 5.51 0.00 -1.26 -4.35 121.76 121.48 2o5j s ALA 830 Ca 0.11 -0.94 -0.00 0.00 0.00 0.00 0.00 51.96 51.13 2o5j s ALA 830 Cb -0.12 -4.57 0.14 0.00 0.00 0.00 0.00 23.12 18.56 2o5j s ALA 830 CO 0.02 -5.72 0.20 0.20 0.00 0.00 0.00 175.76 170.47 2o5j s GLY 831 N 10.33 0.83 0.00 0.00 0.00 -1.26 -4.69 107.32 112.54 2o5j s GLY 831 Ca 0.88 -1.80 0.00 0.00 0.00 0.00 0.00 44.72 43.80 2o5j s GLY 831 CO 0.06 2.08 0.00 -2.13 0.00 0.00 0.00 173.10 173.11 2o5j n ARG 832 N 4.16 0.00 0.00 2.90 0.63 -1.25 -2.19 116.66 120.90 2o5j n ARG 832 Ca 0.10 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.03 2o5j n ARG 832 Cb 0.37 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.28 2o5j n ARG 832 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2o5j n GLU 833 N 0.00 0.00 -3.63 -0.14 4.71 -1.26 -4.67 120.64 115.65 2o5j n GLU 833 Ca 0.00 0.77 -0.16 0.00 -0.01 0.00 0.00 57.16 57.76 2o5j n GLU 833 Cb 0.00 -1.44 -0.14 0.00 -1.01 0.00 0.00 31.44 28.85 2o5j n GLU 833 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 2o5j s THR 834 N -2.77 -0.34 0.63 2.62 -4.23 -0.93 -5.08 115.64 105.55 2o5j s THR 834 Ca 0.00 0.22 -0.17 0.00 -1.18 0.00 0.00 61.69 60.56 2o5j s THR 834 Cb 0.00 -0.44 -0.01 0.00 1.34 0.00 0.00 72.50 73.39 2o5j s THR 834 CO 0.00 0.06 1.20 -0.55 -0.54 0.00 0.00 174.62 174.79 2o5j s SER 835 N 2.35 4.92 0.60 3.99 0.15 -1.20 -4.78 113.70 119.73 2o5j s SER 835 Ca 0.03 2.35 0.28 0.00 0.70 0.00 0.00 55.95 59.31 2o5j s SER 835 Cb -0.13 -2.59 1.30 0.00 -1.71 0.00 0.00 66.02 62.89 2o5j s SER 835 CO -0.08 -1.78 1.71 1.62 1.20 0.00 0.00 173.24 175.91 2o5j h VAL 836 N 0.51 0.22 -0.65 4.45 3.04 -1.79 0.60 116.25 122.62 2o5j h VAL 836 Ca -0.49 0.00 0.15 0.00 -1.01 0.00 0.00 66.70 65.34 2o5j h VAL 836 Cb 1.29 0.43 -0.04 0.00 -2.01 0.00 0.00 31.29 30.97 2o5j h VAL 836 CO 0.54 0.00 0.45 1.23 -1.01 0.00 0.00 177.57 178.78 2o5j h GLY 837 N 0.00 0.40 1.34 3.17 0.00 -1.43 -0.93 103.07 105.62 2o5j h GLY 837 Ca 0.27 -0.10 -0.29 0.00 0.00 0.00 0.00 47.33 47.21 2o5j h GLY 837 CO -0.00 0.04 -1.46 3.21 0.00 0.00 0.00 176.54 178.33 2o5j h ARG 838 N 0.24 0.18 -0.44 4.80 -0.00 0.13 -3.28 114.38 116.01 2o5j h ARG 838 Ca 0.32 -0.31 -0.03 0.00 -0.50 0.00 0.00 59.98 59.45 2o5j h ARG 838 Cb 0.90 0.12 -0.02 0.00 0.00 0.00 0.00 29.97 30.97 2o5j h ARG 838 CO -0.07 1.03 0.14 1.25 0.00 0.00 0.00 179.97 182.33 2o5j h LEU 839 N 0.05 0.64 -0.21 3.04 5.85 -1.17 -3.21 115.31 120.29 2o5j h LEU 839 Ca -0.21 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.30 2o5j h LEU 839 Cb 1.98 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.83 2o5j h LEU 839 CO 0.15 0.67 0.07 0.11 -0.34 0.00 0.00 178.44 179.10 2o5j h LYS 840 N 0.57 0.33 -5.42 1.25 1.57 -1.40 -3.43 116.57 110.05 2o5j h LYS 840 Ca 0.14 -0.07 -0.68 0.00 -1.87 0.00 0.00 60.65 58.17 2o5j h LYS 840 Cb 0.25 -0.05 -0.32 0.00 0.08 0.00 0.00 32.23 32.19 2o5j h LYS 840 CO -0.01 0.42 -0.87 0.71 -0.57 0.00 0.00 179.45 179.13 2o5j s TYR 841 N -5.41 2.56 -0.07 -1.35 4.12 -1.21 -5.09 117.35 110.89 2o5j s TYR 841 Ca -0.14 -0.99 0.01 0.00 0.02 0.00 0.00 57.07 55.98 2o5j s TYR 841 Cb 0.07 -1.70 0.02 0.00 -1.52 0.00 0.00 41.96 38.83 2o5j s TYR 841 CO 0.72 -0.38 -0.08 0.08 0.02 0.00 0.00 175.55 175.90 2o5j s VAL 842 N 0.28 0.89 -0.16 0.71 1.01 -1.26 -3.78 120.40 118.09 2o5j s VAL 842 Ca -0.17 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.54 2o5j s VAL 842 Cb -0.17 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.35 2o5j s VAL 842 CO 0.08 0.31 -0.21 -0.36 0.00 0.00 0.00 175.10 174.93 2o5j s PHE 843 N 1.06 2.72 0.00 5.22 2.99 -0.93 -5.04 117.98 124.00 2o5j s PHE 843 Ca -0.08 -1.44 0.00 0.00 0.00 0.00 0.00 56.93 55.41 2o5j s PHE 843 Cb -0.14 -1.86 0.00 0.00 0.00 0.00 0.00 43.02 41.02 2o5j s PHE 843 CO -0.01 -0.68 0.00 0.00 -0.00 0.00 0.00 175.22 174.53 2o5j n ALA 844 N 4.28 0.00 -1.22 5.36 0.00 -1.26 -1.20 120.51 126.47 2o5j n ALA 844 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 52.93 2o5j n ALA 844 Cb 0.51 0.00 0.12 0.00 0.00 0.00 0.00 19.45 20.08 2o5j n ALA 844 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2o5j s ASN 845 N -2.00 3.92 0.12 0.00 2.47 -1.26 -3.26 114.94 114.93 2o5j s ASN 845 Ca 0.00 1.65 -0.20 0.00 0.42 0.00 0.00 52.86 54.73 2o5j s ASN 845 Cb 0.00 -2.34 -0.06 0.00 -1.45 0.00 0.00 41.25 37.40 2o5j s ASN 845 CO 0.00 -2.38 1.74 -0.65 -3.72 0.00 0.00 177.10 172.09 2o5j h PRO 846 N -1.37 0.09 -0.50 0.43 0.11 -1.89 -3.07 132.00 125.80 2o5j h PRO 846 Ca -0.47 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.74 2o5j h PRO 846 Cb 1.26 -0.02 -0.10 0.00 0.11 0.00 0.00 31.00 32.25 2o5j h PRO 846 CO 0.53 0.06 -0.14 -0.44 -0.21 0.00 0.00 178.00 177.80 2o5j h ASP 847 N 0.09 -0.50 -1.20 -2.05 5.19 -1.97 -1.48 116.42 114.50 2o5j h ASP 847 Ca 0.07 0.15 0.39 0.00 -0.62 0.00 0.00 57.03 57.03 2o5j h ASP 847 Cb 0.07 0.32 -0.13 0.00 0.18 0.00 0.00 39.33 39.77 2o5j h ASP 847 CO -0.10 -0.18 0.75 -0.33 -3.12 0.00 0.00 179.24 176.26 2o5j h GLU 848 N -0.01 0.15 -0.67 3.56 4.39 -1.91 0.19 114.58 120.26 2o5j h GLU 848 Ca 0.24 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.86 2o5j h GLU 848 Cb 0.38 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 2o5j h GLU 848 CO -0.52 0.10 0.12 0.00 -1.16 0.00 0.00 179.01 177.54 2o5j h ALA 849 N 1.69 0.94 0.00 3.43 0.00 -1.35 -3.13 119.26 120.83 2o5j h ALA 849 Ca 0.78 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 55.24 2o5j h ALA 849 Cb 2.26 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.76 2o5j h ALA 849 CO -0.47 0.66 -1.23 -0.07 0.00 0.00 0.00 179.25 178.14 2o5j h LEU 850 N 1.03 0.00 -1.39 0.00 4.07 -0.76 -3.22 115.31 115.04 2o5j h LEU 850 Ca 0.21 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.11 2o5j h LEU 850 Cb 0.42 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.15 2o5j h LEU 850 CO 0.01 0.72 -0.25 -0.07 -1.08 0.00 0.00 178.44 177.77 2o5j h LEU 851 N 0.00 0.00 -0.50 1.67 3.38 -1.40 -1.26 115.31 117.19 2o5j h LEU 851 Ca -0.14 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.68 2o5j h LEU 851 Cb 1.67 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.40 2o5j h LEU 851 CO 0.07 0.25 -0.75 0.00 0.09 0.00 0.00 178.44 178.10 2o5j h ALA 852 N 1.75 0.76 -0.30 1.53 0.00 -1.61 -2.95 119.26 118.44 2o5j h ALA 852 Ca -0.00 -0.68 -0.18 0.00 0.00 0.00 0.00 54.91 54.04 2o5j h ALA 852 Cb 0.62 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2o5j h ALA 852 CO 0.03 0.93 -0.54 0.28 0.00 0.00 0.00 179.25 179.95 2o5j h VAL 853 N 0.01 1.27 0.00 0.00 2.07 -1.32 -1.44 116.25 116.84 2o5j h VAL 853 Ca -0.01 -1.72 -0.04 0.00 0.82 0.00 0.00 66.70 65.76 2o5j h VAL 853 Cb 1.32 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.69 2o5j h VAL 853 CO 0.10 0.56 -0.18 0.00 0.02 0.00 0.00 177.57 178.07 2o5j h ALA 854 N 0.69 1.38 -0.02 1.67 0.00 -1.25 -2.29 119.26 119.45 2o5j h ALA 854 Ca 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2o5j h ALA 854 Cb 1.14 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2o5j h ALA 854 CO 0.12 0.22 -0.07 0.72 0.00 0.00 0.00 179.25 180.24 2o5j n HIS 855 N -3.86 0.00 -0.59 0.00 8.25 -1.12 -4.96 115.22 112.94 2o5j n HIS 855 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2o5j n HIS 855 Cb 0.27 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.36 2o5j n HIS 855 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2o5j n GLY 856 N 1.24 0.69 0.13 -1.41 0.00 -0.86 -4.97 105.19 100.01 2o5j n GLY 856 Ca 0.17 -0.14 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 2o5j n GLY 856 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2o5j h ILE 857 N 0.00 1.39 -3.61 -0.61 1.08 -1.47 -3.46 117.51 110.83 2o5j h ILE 857 Ca 0.00 -2.86 -0.31 0.00 -0.39 0.00 0.00 64.86 61.30 2o5j h ILE 857 Cb 0.00 2.97 -0.32 0.00 -3.07 0.00 0.00 36.82 36.40 2o5j h ILE 857 CO 0.00 0.85 -0.74 0.68 -0.69 0.00 0.00 178.15 178.25 2o5j s VAL 858 N -2.66 0.12 0.65 1.67 -7.23 -1.23 -5.01 120.40 106.72 2o5j s VAL 858 Ca -0.06 0.05 -0.13 0.00 -1.81 0.00 0.00 61.98 60.02 2o5j s VAL 858 Cb 0.06 -0.19 -0.01 0.00 0.56 0.00 0.00 36.38 36.80 2o5j s VAL 858 CO 0.91 0.10 1.06 -0.62 -0.31 0.00 0.00 175.10 176.24 2o5j s ASP 859 N 0.63 5.49 0.48 4.85 3.68 -1.26 -4.23 116.67 126.31 2o5j s ASP 859 Ca -0.06 1.73 0.28 0.00 2.13 0.00 0.00 52.55 56.63 2o5j s ASP 859 Cb -0.09 -2.52 1.04 0.00 -1.45 0.00 0.00 42.92 39.90 2o5j s ASP 859 CO -0.01 -1.37 1.87 -0.07 0.13 0.00 0.00 175.17 175.71 2o5j h LEU 860 N -0.21 0.00 -0.55 -1.34 3.38 -1.93 -2.70 115.31 111.96 2o5j h LEU 860 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2o5j h LEU 860 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2o5j h LEU 860 CO 0.57 0.12 0.00 0.00 0.09 0.00 0.00 178.44 179.22 2o5j n GLN 861 N -3.25 1.38 -2.44 1.13 3.00 -1.26 -1.53 117.38 114.41 2o5j n GLN 861 Ca 0.01 -0.55 -0.29 0.00 -0.01 0.00 0.00 57.00 56.16 2o5j n GLN 861 Cb 0.39 -1.45 -0.00 0.00 0.00 0.00 0.00 30.24 29.19 2o5j n GLN 861 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2o5j s ASP 862 N -1.87 6.27 -0.38 1.08 -0.00 -1.02 -2.05 116.67 118.71 2o5j s ASP 862 Ca 0.39 1.08 -0.18 0.00 -0.00 0.00 0.00 52.55 53.84 2o5j s ASP 862 Cb 0.20 -2.32 0.00 0.00 -0.00 0.00 0.00 42.92 40.81 2o5j s ASP 862 CO 0.32 -0.65 0.51 -0.69 -0.00 0.00 0.00 175.17 174.66 2o5j s VAL 863 N -2.84 5.01 0.27 -1.27 1.01 -1.26 -3.87 120.40 117.44 2o5j s VAL 863 Ca 0.50 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.67 2o5j s VAL 863 Cb -0.10 -4.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 2o5j s VAL 863 CO 0.46 -0.30 0.12 -0.69 0.00 0.00 0.00 175.10 174.69 2o5j s VAL 864 N 2.40 0.45 -0.11 2.92 1.01 -1.26 -3.77 120.40 122.04 2o5j s VAL 864 Ca 0.18 -2.00 -0.05 0.00 0.00 0.00 0.00 61.98 60.11 2o5j s VAL 864 Cb -0.16 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 2o5j s VAL 864 CO 0.14 0.00 0.06 -0.89 0.00 0.00 0.00 175.10 174.42 2o5j s THR 865 N -3.73 4.85 -0.01 3.92 2.01 -1.25 -0.75 115.64 120.68 2o5j s THR 865 Ca 0.37 -0.04 -0.04 0.00 0.31 0.00 0.00 61.69 62.29 2o5j s THR 865 Cb 0.07 -3.09 0.00 0.00 0.01 0.00 0.00 72.50 69.49 2o5j s THR 865 CO 0.15 0.59 0.08 -0.69 -0.69 0.00 0.00 174.62 174.06 2o5j s VAL 866 N -0.77 0.05 -0.45 3.82 1.01 0.19 -2.18 120.40 122.06 2o5j s VAL 866 Ca 0.13 -0.41 -0.22 0.00 0.00 0.00 0.00 61.98 61.47 2o5j s VAL 866 Cb -0.12 -0.26 0.02 0.00 0.00 0.00 0.00 36.38 36.03 2o5j s VAL 866 CO 0.03 -0.23 0.74 -0.60 0.00 0.00 0.00 175.10 175.04 2o5j s ARG 867 N -0.72 3.37 0.14 2.72 3.00 -0.34 -0.38 118.95 126.73 2o5j s ARG 867 Ca -0.08 -0.19 0.01 0.00 -1.00 0.00 0.00 55.73 54.47 2o5j s ARG 867 Cb -0.05 -3.94 0.03 0.00 0.00 0.00 0.00 34.95 30.99 2o5j s ARG 867 CO 0.00 -1.08 0.19 0.98 0.00 0.00 0.00 175.30 175.40 2o5j n TYR 868 N 6.56 -3.08 -0.46 5.12 4.19 -0.04 -4.31 117.16 125.14 2o5j n TYR 868 Ca 0.01 -0.41 0.39 0.00 3.31 0.00 0.00 57.90 61.21 2o5j n TYR 868 Cb 0.48 -0.14 0.67 0.00 0.49 0.00 0.00 39.34 40.84 2o5j n TYR 868 CO 0.00 0.00 0.00 -1.33 0.91 0.00 0.00 176.86 176.44 2o5j n MET 869 N -1.33 -0.04 0.00 2.98 2.81 -1.26 -3.40 117.12 116.88 2o5j n MET 869 Ca 0.03 1.25 0.00 0.00 -1.81 0.00 0.00 57.70 57.18 2o5j n MET 869 Cb 0.13 -2.45 0.00 0.00 -0.71 0.00 0.00 33.22 30.18 2o5j n MET 869 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2o5j n GLY 870 N -1.50 0.67 3.13 3.03 0.00 -1.26 -5.12 105.19 104.13 2o5j n GLY 870 Ca 0.40 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.23 2o5j n GLY 870 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j s LYS 871 N 0.00 0.87 -0.85 1.61 1.02 -1.22 -5.07 119.74 116.10 2o5j s LYS 871 Ca 0.00 -0.72 -0.24 0.00 0.02 0.00 0.00 55.97 55.03 2o5j s LYS 871 Cb 0.00 -0.86 0.05 0.00 -0.52 0.00 0.00 37.83 36.50 2o5j s LYS 871 CO 0.00 0.21 1.29 1.03 -0.92 0.00 0.00 175.35 176.96 2o5j s ARG 872 N -1.10 3.37 -0.21 1.68 0.52 -1.26 -0.86 118.95 121.08 2o5j s ARG 872 Ca 0.01 -0.79 -0.11 0.00 -0.52 0.00 0.00 55.73 54.31 2o5j s ARG 872 Cb -0.08 -4.70 -0.05 0.00 0.52 0.00 0.00 34.95 30.65 2o5j s ARG 872 CO 0.01 -2.09 0.17 -0.51 0.02 0.00 0.00 175.30 172.90 2o5j s LEU 873 N 4.94 4.18 -1.00 2.53 1.43 0.49 -4.91 118.68 126.33 2o5j s LEU 873 Ca 0.37 0.23 -0.17 0.00 -1.03 0.00 0.00 54.13 53.53 2o5j s LEU 873 Cb -0.06 -2.14 0.15 0.00 0.03 0.00 0.00 46.19 44.17 2o5j s LEU 873 CO 0.03 0.12 1.19 -1.61 0.23 0.00 0.00 176.35 176.31 2o5j s GLU 874 N 0.65 3.75 -0.09 1.70 8.01 -1.26 0.54 118.70 132.00 2o5j s GLU 874 Ca 0.09 -2.07 -0.09 0.00 0.01 0.00 0.00 54.97 52.92 2o5j s GLU 874 Cb -0.12 -4.92 0.02 0.00 -4.31 0.00 0.00 34.13 24.80 2o5j s GLU 874 CO 0.01 -1.73 0.25 0.99 0.01 0.00 0.00 175.26 174.79 2o5j s THR 875 N 2.12 0.00 0.84 3.63 2.01 0.07 -4.89 115.64 119.42 2o5j s THR 875 Ca 0.34 -0.00 -0.15 0.00 0.31 0.00 0.00 61.69 62.19 2o5j s THR 875 Cb -0.05 -0.35 -0.03 0.00 0.01 0.00 0.00 72.50 72.08 2o5j s THR 875 CO -0.07 -0.00 0.24 -1.54 -0.69 0.00 0.00 174.62 172.56 2o5j n SER 876 N 2.94 -2.41 -0.23 3.53 3.41 -1.26 -4.30 113.62 115.31 2o5j n SER 876 Ca -0.13 0.43 -0.08 0.00 -0.26 0.00 0.00 58.87 58.83 2o5j n SER 876 Cb 0.58 -1.12 0.03 0.00 -0.26 0.00 0.00 64.21 63.44 2o5j n SER 876 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2o5j h PRO 877 N -0.91 1.07 -0.76 4.33 0.11 -1.66 -2.68 132.00 131.50 2o5j h PRO 877 Ca -0.44 -0.30 -0.00 0.00 0.11 0.00 0.00 66.00 65.37 2o5j h PRO 877 Cb 1.32 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 2o5j h PRO 877 CO 0.36 1.00 0.46 0.78 -0.21 0.00 0.00 178.00 180.39 2o5j h GLY 878 N 0.98 1.11 1.66 -0.55 0.00 -1.37 0.24 103.07 105.13 2o5j h GLY 878 Ca 0.19 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 46.98 2o5j h GLY 878 CO 0.02 0.45 -0.21 3.21 0.00 0.00 0.00 176.54 180.00 2o5j h ARG 879 N 1.05 0.40 -0.05 4.80 2.47 -1.64 -1.51 114.38 119.90 2o5j h ARG 879 Ca 0.27 -0.13 -0.18 0.00 -1.26 0.00 0.00 59.98 58.68 2o5j h ARG 879 Cb -0.04 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.24 2o5j h ARG 879 CO -0.05 0.60 -0.76 0.82 0.56 0.00 0.00 179.97 181.14 2o5j h ILE 880 N 0.37 1.41 -0.14 2.04 1.08 -1.09 -3.00 117.51 118.17 2o5j h ILE 880 Ca 0.06 -2.24 -0.04 0.00 -0.39 0.00 0.00 64.86 62.24 2o5j h ILE 880 Cb 0.58 2.20 -0.00 0.00 -3.07 0.00 0.00 36.82 36.52 2o5j h ILE 880 CO 0.04 0.67 -0.08 0.25 -0.69 0.00 0.00 178.15 178.33 2o5j h LEU 881 N 0.22 0.32 -0.92 1.44 5.85 -0.73 -2.80 115.31 118.69 2o5j h LEU 881 Ca -0.03 -0.43 0.14 0.00 0.84 0.00 0.00 57.88 58.40 2o5j h LEU 881 Cb 1.34 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 42.19 2o5j h LEU 881 CO 0.13 0.68 0.53 0.15 -0.34 0.00 0.00 178.44 179.58 2o5j h PHE 882 N -0.04 0.94 -0.97 1.25 3.57 -1.32 0.41 116.94 120.78 2o5j h PHE 882 Ca 0.03 0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.69 2o5j h PHE 882 Cb 0.56 -0.28 -0.09 0.00 2.79 0.00 0.00 35.95 38.94 2o5j h PHE 882 CO 0.07 0.28 0.59 0.00 -2.23 0.00 0.00 178.31 177.02 2o5j h ALA 883 N 1.56 1.47 0.24 2.41 0.00 -1.39 -2.34 119.26 121.22 2o5j h ALA 883 Ca 0.49 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.42 2o5j h ALA 883 Cb 0.64 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2o5j h ALA 883 CO -0.33 0.16 -0.12 -0.09 0.00 0.00 0.00 179.25 178.87 2o5j h ARG 884 N 0.92 -0.31 -0.81 0.00 2.43 -0.70 0.71 114.38 116.63 2o5j h ARG 884 Ca 0.49 0.02 0.14 0.00 -0.81 0.00 0.00 59.98 59.82 2o5j h ARG 884 Cb 0.53 0.07 -0.14 0.00 -0.42 0.00 0.00 29.97 30.01 2o5j h ARG 884 CO -0.28 0.04 -0.34 0.82 -1.51 0.00 0.00 179.97 178.70 2o5j h ILE 885 N -0.76 0.09 -0.06 1.20 2.04 -0.97 1.55 117.51 120.59 2o5j h ILE 885 Ca -0.03 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 2o5j h ILE 885 Cb 0.50 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2o5j h ILE 885 CO 0.05 0.00 0.01 0.58 0.00 0.00 0.00 178.15 178.79 2o5j h VAL 886 N -0.07 1.22 -0.47 1.67 2.07 -1.50 0.12 116.25 119.29 2o5j h VAL 886 Ca 0.31 -0.67 0.10 0.00 0.82 0.00 0.00 66.70 67.26 2o5j h VAL 886 Cb 0.58 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 2o5j h VAL 886 CO -0.84 0.19 0.33 0.00 0.02 0.00 0.00 177.57 177.26 2o5j h ALA 887 N 0.76 2.21 0.00 1.67 0.00 0.11 -2.43 119.26 121.58 2o5j h ALA 887 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2o5j h ALA 887 Cb 0.29 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2o5j h ALA 887 CO 0.00 -0.33 -0.05 0.93 0.00 0.00 0.00 179.25 179.80 2o5j h GLU 888 N 0.17 0.00 -0.99 0.00 4.39 0.24 -3.29 114.58 115.10 2o5j h GLU 888 Ca 0.22 0.00 0.30 0.00 0.34 0.00 0.00 59.36 60.22 2o5j h GLU 888 Cb 0.64 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 29.11 2o5j h GLU 888 CO -0.03 0.57 0.10 0.00 -1.16 0.00 0.00 179.01 178.48 2o5j n ALA 889 N -2.73 0.58 -3.92 3.43 0.00 0.39 -3.38 120.51 114.89 2o5j n ALA 889 Ca -0.07 1.06 -0.30 0.00 0.00 0.00 0.00 53.44 54.13 2o5j n ALA 889 Cb 0.28 -0.81 -0.15 0.00 0.00 0.00 0.00 19.45 18.77 2o5j n ALA 889 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2o5j s VAL 890 N -5.92 1.63 0.66 0.00 -7.23 -0.94 -4.63 120.40 103.97 2o5j s VAL 890 Ca -0.12 -1.62 0.22 0.00 -1.81 0.00 0.00 61.98 58.65 2o5j s VAL 890 Cb 0.30 -2.05 0.23 0.00 0.56 0.00 0.00 36.38 35.41 2o5j s VAL 890 CO 0.77 -0.38 1.65 -0.08 -0.31 0.00 0.00 175.10 176.75 2o5j h GLU 891 N 7.87 0.00 -5.08 4.82 4.57 -1.62 -3.33 114.58 121.81 2o5j h GLU 891 Ca -0.13 0.00 -0.69 0.00 -1.18 0.00 0.00 59.36 57.37 2o5j h GLU 891 Cb 1.04 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.57 2o5j h GLU 891 CO 0.46 0.00 2.57 -0.25 -1.18 0.00 0.00 179.01 180.61 2o5j n ASP 892 N -2.87 4.45 -0.28 1.04 8.00 -1.26 -4.77 116.55 120.85 2o5j n ASP 892 Ca 0.00 -2.88 0.07 0.00 0.71 0.00 0.00 54.79 52.70 2o5j n ASP 892 Cb 0.62 -1.71 0.19 0.00 -0.02 0.00 0.00 41.12 40.20 2o5j n ASP 892 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 2o5j h GLU 893 N 6.97 0.10 -0.63 -1.24 4.81 -1.76 0.11 114.58 122.94 2o5j h GLU 893 Ca 0.49 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.71 2o5j h GLU 893 Cb 0.78 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 2o5j h GLU 893 CO 1.64 0.07 0.36 -0.22 -0.73 0.00 0.00 179.01 180.12 2o5j h LYS 894 N 0.10 0.88 0.00 1.92 3.11 -1.94 0.29 116.57 120.93 2o5j h LYS 894 Ca 0.46 -0.10 0.00 0.00 -2.81 0.00 0.00 60.65 58.20 2o5j h LYS 894 Cb 0.84 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.89 2o5j h LYS 894 CO -0.71 0.65 0.00 0.28 -2.81 0.00 0.00 179.45 176.87 2o5j h VAL 895 N 0.86 0.00 0.07 2.00 2.07 -1.24 -2.32 116.25 117.69 2o5j h VAL 895 Ca 0.22 -0.19 -0.23 0.00 0.82 0.00 0.00 66.70 67.32 2o5j h VAL 895 Cb 0.02 0.92 0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2o5j h VAL 895 CO -0.04 0.00 -0.94 0.00 0.02 0.00 0.00 177.57 176.61 2o5j h ALA 896 N 2.13 0.02 0.00 1.67 0.00 0.34 -3.25 119.26 120.17 2o5j h ALA 896 Ca 0.00 -0.69 -0.02 0.00 0.00 0.00 0.00 54.91 54.20 2o5j h ALA 896 Cb 0.26 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2o5j h ALA 896 CO 0.00 0.52 -0.11 0.11 0.00 0.00 0.00 179.25 179.77 2o5j h TRP 897 N 0.05 0.00 -0.26 0.00 5.08 -1.02 -2.97 115.95 116.83 2o5j h TRP 897 Ca -0.14 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.76 2o5j h TRP 897 Cb 1.65 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.80 2o5j h TRP 897 CO 0.14 0.11 -0.16 1.49 -1.28 0.00 0.00 178.44 178.74 2o5j h GLU 898 N 0.00 0.46 -0.52 0.12 4.81 -1.51 -2.96 114.58 114.98 2o5j h GLU 898 Ca -0.00 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.09 2o5j h GLU 898 Cb 1.05 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.38 2o5j h GLU 898 CO 0.01 0.61 0.00 1.47 -0.73 0.00 0.00 179.01 180.38 2o5j n LEU 899 N -4.18 3.48 -4.36 1.64 -0.00 -1.20 -4.96 117.00 107.41 2o5j n LEU 899 Ca 0.00 -1.85 -0.30 0.00 -0.00 0.00 0.00 56.01 53.87 2o5j n LEU 899 Cb 0.34 -0.35 -0.14 0.00 -0.00 0.00 0.00 43.42 43.28 2o5j n LEU 899 CO 0.40 0.84 -0.57 0.27 -0.00 0.00 0.00 177.39 178.33 2o5j s ILE 900 N -1.10 2.19 -0.42 1.47 -4.36 -1.12 -4.75 121.20 113.11 2o5j s ILE 900 Ca 0.38 -1.56 -0.07 0.00 -0.26 0.00 0.00 60.65 59.15 2o5j s ILE 900 Cb 0.20 -1.90 0.10 0.00 1.25 0.00 0.00 42.46 42.11 2o5j s ILE 900 CO 0.27 0.24 0.25 0.00 0.24 0.00 0.00 174.94 175.94 2o5j s GLN 901 N -1.61 2.37 -0.18 0.37 -2.07 -1.26 -4.89 119.66 112.39 2o5j s GLN 901 Ca 0.13 -1.64 0.11 0.00 -1.82 0.00 0.00 55.36 52.14 2o5j s GLN 901 Cb -0.10 -3.72 0.64 0.00 -1.09 0.00 0.00 33.01 28.75 2o5j s GLN 901 CO 0.04 -1.03 1.48 1.47 -1.32 0.00 0.00 175.29 175.93 2o5j n LEU 902 N 4.79 4.67 -1.11 2.60 -0.00 -1.26 -4.24 117.00 122.45 2o5j n LEU 902 Ca -0.07 -2.37 0.08 0.00 -0.00 0.00 0.00 56.01 53.65 2o5j n LEU 902 Cb 0.42 -0.64 0.27 0.00 -0.00 0.00 0.00 43.42 43.47 2o5j n LEU 902 CO 0.37 0.56 0.73 0.47 -0.00 0.00 0.00 177.39 179.52 2o5j n ASP 903 N 0.52 3.93 -3.67 1.45 10.43 -1.26 -4.98 116.55 122.96 2o5j n ASP 903 Ca 0.22 -2.41 -0.09 0.00 2.57 0.00 0.00 54.79 55.08 2o5j n ASP 903 Cb 0.98 -0.45 -0.02 0.00 1.84 0.00 0.00 41.12 43.46 2o5j n ASP 903 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 2o5j s VAL 904 N -1.75 0.00 0.25 2.53 -7.23 -1.26 -5.14 120.40 107.81 2o5j s VAL 904 Ca 0.40 -0.58 -0.30 0.00 -1.81 0.00 0.00 61.98 59.70 2o5j s VAL 904 Cb 0.26 -1.57 -0.09 0.00 0.56 0.00 0.00 36.38 35.54 2o5j s VAL 904 CO 0.19 -0.01 1.21 -2.84 -0.31 0.00 0.00 175.10 173.34 2o5j s PRO 905 N -3.85 4.49 -0.48 4.82 0.02 -1.26 -4.91 135.00 133.83 2o5j s PRO 905 Ca 0.07 1.97 -0.28 0.00 0.02 0.00 0.00 61.00 62.78 2o5j s PRO 905 Cb -0.04 -3.17 -0.00 0.00 0.02 0.00 0.00 34.50 31.31 2o5j s PRO 905 CO -0.02 -0.04 1.57 -0.65 -0.33 0.00 0.00 177.00 177.53 2o5j s GLN 906 N -1.00 3.26 0.58 5.54 -1.52 -1.26 -4.95 119.66 120.32 2o5j s GLN 906 Ca 0.50 0.82 0.00 0.00 -1.95 0.00 0.00 55.36 54.73 2o5j s GLN 906 Cb -0.35 -4.16 0.04 0.00 -0.22 0.00 0.00 33.01 28.33 2o5j s GLN 906 CO 0.42 -1.96 0.82 -2.00 -0.25 0.00 0.00 175.29 172.33 2o5j s GLU 907 N 5.66 2.43 0.49 2.91 -6.30 -1.26 -4.07 118.70 118.56 2o5j s GLU 907 Ca 0.63 -0.74 0.15 0.00 -2.50 0.00 0.00 54.97 52.51 2o5j s GLU 907 Cb -0.14 -2.43 1.18 0.00 0.00 0.00 0.00 34.13 32.74 2o5j s GLU 907 CO 0.28 -0.84 2.11 -0.22 0.02 0.00 0.00 175.26 176.61 2o5j h LYS 908 N -0.07 0.13 0.00 4.30 3.64 -1.86 -1.82 116.57 120.90 2o5j h LYS 908 Ca -0.42 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 58.81 2o5j h LYS 908 Cb 1.30 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 33.10 2o5j h LYS 908 CO 0.52 0.09 -0.57 -0.91 -2.27 0.00 0.00 179.45 176.31 2o5j h ASN 909 N 0.14 0.49 -0.98 4.20 4.21 -1.94 0.58 115.58 122.28 2o5j h ASN 909 Ca 0.07 -0.77 0.09 0.00 1.21 0.00 0.00 56.30 56.90 2o5j h ASN 909 Cb 0.12 -0.15 -0.07 0.00 -1.12 0.00 0.00 38.32 37.10 2o5j h ASN 909 CO -0.01 1.20 0.62 -1.28 -1.29 0.00 0.00 177.43 176.67 2o5j h SER 910 N -0.16 0.96 -0.04 5.81 0.87 -1.82 0.12 113.55 119.29 2o5j h SER 910 Ca -0.07 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.49 2o5j h SER 910 Cb 1.29 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 63.08 2o5j h SER 910 CO 0.11 0.57 -0.06 -0.07 -0.53 0.00 0.00 176.83 176.85 2o5j h LEU 911 N 1.07 0.13 -0.84 2.23 4.07 -1.33 -1.88 115.31 118.76 2o5j h LEU 911 Ca 0.45 -0.53 0.20 0.00 0.08 0.00 0.00 57.88 58.08 2o5j h LEU 911 Cb 0.31 -0.04 -0.12 0.00 1.08 0.00 0.00 40.66 41.89 2o5j h LEU 911 CO -0.22 0.63 0.29 0.50 -1.08 0.00 0.00 178.44 178.57 2o5j h LYS 912 N -0.38 0.31 -0.63 1.13 3.64 0.80 0.18 116.57 121.62 2o5j h LYS 912 Ca 0.00 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.28 2o5j h LYS 912 Cb 0.60 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.33 2o5j h LYS 912 CO 0.01 0.21 0.08 0.22 -2.27 0.00 0.00 179.45 177.70 2o5j h ASP 913 N 0.32 1.01 -0.14 4.20 -0.00 -0.74 -2.84 116.42 118.23 2o5j h ASP 913 Ca 0.51 -0.25 -0.02 0.00 -0.00 0.00 0.00 57.03 57.27 2o5j h ASP 913 Cb 0.94 -0.27 -0.01 0.00 -0.00 0.00 0.00 39.33 40.00 2o5j h ASP 913 CO -0.55 1.02 0.01 0.25 -0.00 0.00 0.00 179.24 179.98 2o5j h LEU 914 N 0.98 0.24 -0.02 2.28 6.46 0.16 -1.17 115.31 124.24 2o5j h LEU 914 Ca 0.19 -0.28 0.02 0.00 -0.12 0.00 0.00 57.88 57.69 2o5j h LEU 914 Cb 0.46 -0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.30 2o5j h LEU 914 CO 0.02 0.46 -0.13 0.58 -0.62 0.00 0.00 178.44 178.75 2o5j h VAL 915 N 0.01 0.68 -0.16 1.05 2.07 -1.22 0.16 116.25 118.84 2o5j h VAL 915 Ca 0.04 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.61 2o5j h VAL 915 Cb 0.33 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 2o5j h VAL 915 CO 0.00 0.00 -0.29 0.22 0.02 0.00 0.00 177.57 177.53 2o5j h TYR 916 N -0.20 -0.79 0.03 1.57 3.20 -1.47 0.57 116.97 119.89 2o5j h TYR 916 Ca 0.05 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.99 2o5j h TYR 916 Cb 0.27 0.37 -0.05 0.00 1.54 0.00 0.00 36.73 38.86 2o5j h TYR 916 CO -0.19 -0.37 -0.37 0.37 -1.64 0.00 0.00 178.16 175.96 2o5j h GLN 917 N -0.34 -0.53 -0.96 1.82 5.75 -0.97 -0.93 115.11 118.95 2o5j h GLN 917 Ca 0.11 0.04 0.18 0.00 -0.15 0.00 0.00 58.65 58.83 2o5j h GLN 917 Cb 0.51 0.12 -0.09 0.00 1.07 0.00 0.00 27.48 29.10 2o5j h GLN 917 CO -0.36 -0.35 0.61 0.00 -2.65 0.00 0.00 178.83 176.08 2o5j h ALA 918 N 0.07 1.88 0.65 3.38 0.00 0.00 0.17 119.26 125.40 2o5j h ALA 918 Ca 0.05 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2o5j h ALA 918 Cb 0.62 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2o5j h ALA 918 CO -0.27 -0.20 -0.47 0.35 0.00 0.00 0.00 179.25 178.66 2o5j h PHE 919 N 0.64 -1.28 -0.03 0.00 3.57 0.15 -1.08 116.94 118.91 2o5j h PHE 919 Ca 0.52 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 62.01 2o5j h PHE 919 Cb 0.95 0.47 -0.00 0.00 2.79 0.00 0.00 35.95 40.16 2o5j h PHE 919 CO -0.00 -0.67 0.01 -0.07 -2.23 0.00 0.00 178.31 175.34 2o5j h LEU 920 N -1.07 0.04 0.79 0.59 4.07 -0.62 -2.68 115.31 116.43 2o5j h LEU 920 Ca -0.09 -0.17 -0.04 0.00 0.08 0.00 0.00 57.88 57.66 2o5j h LEU 920 Cb 0.88 -0.01 0.01 0.00 1.08 0.00 0.00 40.66 42.62 2o5j h LEU 920 CO 0.04 0.20 -0.38 0.03 -1.08 0.00 0.00 178.44 177.25 2o5j h ARG 921 N -0.13 -1.02 0.00 1.13 2.47 -0.71 -3.39 114.38 112.74 2o5j h ARG 921 Ca 0.01 0.07 -0.16 0.00 -1.26 0.00 0.00 59.98 58.64 2o5j h ARG 921 Cb 0.18 0.23 -0.03 0.00 -1.65 0.00 0.00 29.97 28.70 2o5j h ARG 921 CO -0.00 -0.68 -1.87 1.47 0.56 0.00 0.00 179.97 179.45 2o5j n LEU 922 N -5.47 0.32 0.00 3.04 -0.00 -0.42 -5.07 117.00 109.39 2o5j n LEU 922 Ca -0.13 0.14 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2o5j n LEU 922 Cb 0.42 0.17 0.00 0.00 -0.00 0.00 0.00 43.42 44.00 2o5j n LEU 922 CO 0.32 0.18 0.00 0.61 -0.00 0.00 0.00 177.39 178.50 2o5j n GLY 923 N 1.44 3.47 0.00 1.47 0.00 -1.01 -4.80 105.19 105.76 2o5j n GLY 923 Ca -0.14 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.11 2o5j n GLY 923 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2o5j n MET 924 N -1.09 0.00 -0.21 1.61 0.00 -1.26 -1.88 117.12 114.28 2o5j n MET 924 Ca 0.00 0.36 0.15 0.00 -0.00 0.00 0.00 57.70 58.21 2o5j n MET 924 Cb 0.00 -1.10 0.47 0.00 0.00 0.00 0.00 33.22 32.59 2o5j n MET 924 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 175.97 177.02 2o5j h GLU 925 N 0.00 0.48 -0.44 2.12 9.09 -1.94 0.12 114.58 124.01 2o5j h GLU 925 Ca 0.00 -0.03 -0.01 0.00 0.05 0.00 0.00 59.36 59.37 2o5j h GLU 925 Cb 0.00 -0.11 -0.02 0.00 -1.65 0.00 0.00 28.75 26.97 2o5j h GLU 925 CO 0.00 0.32 0.21 0.87 0.05 0.00 0.00 179.01 180.46 2o5j h LYS 926 N 0.50 0.61 -0.44 1.06 1.57 -1.85 -1.74 116.57 116.27 2o5j h LYS 926 Ca 0.41 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 59.04 2o5j h LYS 926 Cb 0.86 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 2o5j h LYS 926 CO -0.15 0.48 -0.03 1.15 -0.57 0.00 0.00 179.45 180.33 2o5j h THR 927 N 0.61 1.27 -0.74 -0.16 2.02 -0.05 -2.91 112.91 112.95 2o5j h THR 927 Ca 0.16 -1.09 0.11 0.00 0.77 0.00 0.00 66.41 66.36 2o5j h THR 927 Cb 0.07 1.09 -0.08 0.00 -1.74 0.00 0.00 68.15 67.49 2o5j h THR 927 CO -0.02 0.37 0.35 0.00 0.37 0.00 0.00 175.52 176.59 2o5j h ALA 928 N 0.89 1.03 -0.12 6.16 0.00 -0.72 0.69 119.26 127.20 2o5j h ALA 928 Ca 0.12 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.14 2o5j h ALA 928 Cb 0.53 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2o5j h ALA 928 CO 0.03 -0.10 -0.06 0.00 0.00 0.00 0.00 179.25 179.12 2o5j h ARG 929 N 0.55 -0.05 -0.82 0.00 3.08 -1.23 -2.21 114.38 113.70 2o5j h ARG 929 Ca 0.38 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.46 2o5j h ARG 929 Cb 0.48 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.49 2o5j h ARG 929 CO -0.32 -0.03 0.54 1.25 -1.07 0.00 0.00 179.97 180.34 2o5j h LEU 930 N -0.05 0.88 0.31 3.04 5.85 -1.06 -0.55 115.31 123.73 2o5j h LEU 930 Ca 0.07 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2o5j h LEU 930 Cb 0.15 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 2o5j h LEU 930 CO -0.15 0.61 -0.35 -0.07 -0.34 0.00 0.00 178.44 178.13 2o5j h LEU 931 N 1.03 -0.97 -0.79 2.25 3.38 -0.33 -0.80 115.31 119.08 2o5j h LEU 931 Ca 0.32 0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.39 2o5j h LEU 931 Cb 0.01 0.34 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 2o5j h LEU 931 CO -0.09 -0.48 0.51 0.44 0.09 0.00 0.00 178.44 178.91 2o5j h ASP 932 N -0.71 0.91 -0.13 -0.43 3.32 -1.12 -0.82 116.42 117.44 2o5j h ASP 932 Ca -0.01 -0.03 0.04 0.00 0.02 0.00 0.00 57.03 57.05 2o5j h ASP 932 Cb 0.65 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.91 2o5j h ASP 932 CO -0.09 0.67 -0.42 0.00 -1.72 0.00 0.00 179.24 177.68 2o5j h ALA 933 N 1.28 -0.60 -0.39 3.45 0.00 -0.70 0.28 119.26 122.57 2o5j h ALA 933 Ca 0.29 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 2o5j h ALA 933 Cb -0.11 0.79 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2o5j h ALA 933 CO -0.06 -0.93 0.05 -0.07 0.00 0.00 0.00 179.25 178.24 2o5j h LEU 934 N -0.49 0.56 0.00 0.00 3.38 -0.97 -2.24 115.31 115.55 2o5j h LEU 934 Ca 0.07 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.97 2o5j h LEU 934 Cb 0.63 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 2o5j h LEU 934 CO -0.40 0.60 -0.19 0.50 0.09 0.00 0.00 178.44 179.04 2o5j h LYS 935 N 0.58 -0.30 0.96 1.13 3.64 0.05 0.24 116.57 122.87 2o5j h LYS 935 Ca 0.13 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 2o5j h LYS 935 Cb 0.30 0.07 0.01 0.00 -0.41 0.00 0.00 32.23 32.19 2o5j h LYS 935 CO 0.00 -0.20 -0.47 -0.92 -2.27 0.00 0.00 179.45 175.59 2o5j h TYR 936 N -0.31 -1.23 -0.46 1.91 -0.00 -0.20 -2.00 116.97 114.68 2o5j h TYR 936 Ca 0.06 -0.03 -0.06 0.00 -0.00 0.00 0.00 58.73 58.70 2o5j h TYR 936 Cb 0.38 0.41 -0.02 0.00 -0.00 0.00 0.00 36.73 37.50 2o5j h TYR 936 CO -0.24 -0.76 0.06 1.88 -0.00 0.00 0.00 178.16 179.10 2o5j h TYR 937 N -1.30 0.75 -0.82 -3.82 -1.99 -1.43 -0.73 116.97 107.63 2o5j h TYR 937 Ca -0.13 -0.08 0.01 0.00 2.00 0.00 0.00 58.73 60.52 2o5j h TYR 937 Cb 1.00 -0.22 -0.04 0.00 2.00 0.00 0.00 36.73 39.48 2o5j h TYR 937 CO -0.02 0.68 0.53 0.78 -0.00 0.00 0.00 178.16 180.13 2o5j h GLY 938 N 0.93 1.16 0.67 3.88 0.00 -0.48 -1.00 103.07 108.23 2o5j h GLY 938 Ca 0.15 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 2o5j h GLY 938 CO 0.01 0.43 -0.05 0.74 0.00 0.00 0.00 176.54 177.67 2o5j h PHE 939 N 1.11 -0.12 0.23 5.60 0.05 -0.88 -2.41 116.94 120.52 2o5j h PHE 939 Ca 0.30 -0.00 -0.00 0.00 3.82 0.00 0.00 57.97 62.08 2o5j h PHE 939 Cb -0.11 0.04 -0.02 0.00 2.00 0.00 0.00 35.95 37.86 2o5j h PHE 939 CO -0.01 0.21 -0.30 1.15 -0.18 0.00 0.00 178.31 179.18 2o5j h THR 940 N -0.46 0.00 -0.84 -1.55 2.02 -0.99 -2.33 112.91 108.77 2o5j h THR 940 Ca -0.01 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.39 2o5j h THR 940 Cb 0.38 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.75 2o5j h THR 940 CO 0.02 0.00 0.59 -0.26 0.37 0.00 0.00 175.52 176.24 2o5j h PHE 941 N -0.55 0.18 -0.35 3.16 0.05 -1.30 -1.59 116.94 116.54 2o5j h PHE 941 Ca -0.03 0.01 -0.01 0.00 3.82 0.00 0.00 57.97 61.76 2o5j h PHE 941 Cb 0.49 -0.05 -0.02 0.00 2.00 0.00 0.00 35.95 38.37 2o5j h PHE 941 CO -0.24 0.05 0.18 0.66 -0.18 0.00 0.00 178.31 178.77 2o5j h SER 942 N 0.13 0.46 0.07 2.17 4.64 -0.89 0.79 113.55 120.92 2o5j h SER 942 Ca 0.41 -0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2o5j h SER 942 Cb 1.42 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2o5j h SER 942 CO -0.06 0.45 -0.03 0.71 -0.87 0.00 0.00 176.83 177.02 2o5j h THR 943 N 0.44 1.01 -0.61 2.95 1.35 -0.99 -3.21 112.91 113.84 2o5j h THR 943 Ca 0.12 -0.25 -0.09 0.00 -0.55 0.00 0.00 66.41 65.65 2o5j h THR 943 Cb 0.11 1.17 -0.02 0.00 -1.73 0.00 0.00 68.15 67.67 2o5j h THR 943 CO -0.02 0.06 0.04 0.71 -0.25 0.00 0.00 175.52 176.07 2o5j h THR 944 N -0.20 1.26 -0.59 6.82 1.35 -1.43 -2.89 112.91 117.24 2o5j h THR 944 Ca -0.01 -1.09 0.17 0.00 -0.55 0.00 0.00 66.41 64.94 2o5j h THR 944 Cb 0.17 0.74 -0.02 0.00 -1.73 0.00 0.00 68.15 67.31 2o5j h THR 944 CO 0.02 0.40 0.52 0.77 -0.25 0.00 0.00 175.52 176.97 2o5j h SER 945 N 0.96 0.00 -2.16 5.36 4.64 -0.84 -3.45 113.55 118.06 2o5j h SER 945 Ca 0.18 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.15 2o5j h SER 945 Cb 0.49 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.54 2o5j h SER 945 CO 0.02 0.00 -0.42 0.61 -0.87 0.00 0.00 176.83 176.17 2o5j n GLY 946 N -1.58 0.07 3.71 -0.77 0.00 -1.09 -4.97 105.19 100.55 2o5j n GLY 946 Ca 0.11 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2o5j n GLY 946 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2o5j s ILE 947 N -2.83 4.43 -0.00 -0.61 -5.25 -1.26 -5.01 121.20 110.66 2o5j s ILE 947 Ca 0.00 1.74 -0.17 0.00 -0.99 0.00 0.00 60.65 61.23 2o5j s ILE 947 Cb 0.00 -4.12 0.03 0.00 2.95 0.00 0.00 42.46 41.32 2o5j s ILE 947 CO 0.00 0.10 0.37 0.42 -1.79 0.00 0.00 174.94 174.04 2o5j s THR 948 N 1.32 0.05 0.29 8.37 -4.23 -1.26 -5.08 115.64 115.11 2o5j s THR 948 Ca 0.55 -0.45 -0.20 0.00 -1.18 0.00 0.00 61.69 60.42 2o5j s THR 948 Cb -0.25 -0.76 -0.09 0.00 1.34 0.00 0.00 72.50 72.75 2o5j s THR 948 CO 0.27 -0.25 0.79 -0.63 -0.54 0.00 0.00 174.62 174.26 2o5j s ILE 949 N -1.65 4.52 -0.00 2.99 -1.09 -1.26 -4.66 121.20 120.05 2o5j s ILE 949 Ca -0.11 1.30 0.01 0.00 -2.23 0.00 0.00 60.65 59.62 2o5j s ILE 949 Cb -0.03 -3.78 -0.00 0.00 -1.58 0.00 0.00 42.46 37.06 2o5j s ILE 949 CO 0.03 0.02 -0.02 -0.83 -1.23 0.00 0.00 174.94 172.91 2o5j s GLY 950 N -1.89 0.10 0.29 6.18 0.00 -1.26 -5.00 107.32 105.74 2o5j s GLY 950 Ca 0.50 -0.09 0.04 0.00 0.00 0.00 0.00 44.72 45.17 2o5j s GLY 950 CO 0.19 -0.07 1.70 1.19 0.00 0.00 0.00 173.10 176.11 2o5j h ILE 951 N 5.10 0.49 -0.18 0.90 -0.00 -1.97 1.13 117.51 122.98 2o5j h ILE 951 Ca -0.25 -0.15 -0.03 0.00 -0.00 0.00 0.00 64.86 64.43 2o5j h ILE 951 Cb 1.20 0.02 -0.01 0.00 -0.00 0.00 0.00 36.82 38.03 2o5j h ILE 951 CO 0.51 0.08 -0.01 0.44 -0.00 0.00 0.00 178.15 179.17 2o5j h ASP 952 N 0.43 0.24 -0.54 2.19 3.45 -2.00 -2.47 116.42 117.72 2o5j h ASP 952 Ca 0.57 -0.03 0.10 0.00 0.43 0.00 0.00 57.03 58.10 2o5j h ASP 952 Cb 1.07 -0.06 -0.08 0.00 -0.56 0.00 0.00 39.33 39.70 2o5j h ASP 952 CO -0.52 0.30 0.05 0.44 -1.57 0.00 0.00 179.24 177.94 2o5j h ASP 953 N 0.26 -0.13 -1.86 6.45 3.45 0.94 -3.30 116.42 122.23 2o5j h ASP 953 Ca 0.06 0.12 -0.51 0.00 0.43 0.00 0.00 57.03 57.13 2o5j h ASP 953 Cb 0.20 0.19 -0.00 0.00 -0.56 0.00 0.00 39.33 39.16 2o5j h ASP 953 CO 0.00 -0.04 1.53 0.00 -1.57 0.00 0.00 179.24 179.16 2o5j s ALA 954 N -6.14 2.11 -0.23 3.45 0.00 -0.93 -4.86 121.76 115.15 2o5j s ALA 954 Ca -0.13 0.18 -0.08 0.00 0.00 0.00 0.00 51.96 51.93 2o5j s ALA 954 Cb 0.17 -4.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.01 2o5j s ALA 954 CO 0.73 -3.77 0.09 0.08 0.00 0.00 0.00 175.76 172.89 2o5j s VAL 955 N 10.29 4.70 0.05 0.00 1.01 -1.24 -4.96 120.40 130.25 2o5j s VAL 955 Ca 0.93 -0.05 -0.27 0.00 0.00 0.00 0.00 61.98 62.59 2o5j s VAL 955 Cb -0.22 -3.18 -0.05 0.00 0.00 0.00 0.00 36.38 32.93 2o5j s VAL 955 CO 0.29 0.36 0.87 -0.63 0.00 0.00 0.00 175.10 175.98 2o5j s ILE 956 N 1.21 4.70 0.39 2.22 1.01 -1.26 -4.83 121.20 124.65 2o5j s ILE 956 Ca 0.05 1.84 -0.24 0.00 0.00 0.00 0.00 60.65 62.30 2o5j s ILE 956 Cb -0.14 -4.22 -0.09 0.00 0.01 0.00 0.00 42.46 38.02 2o5j s ILE 956 CO 0.04 0.30 1.07 -2.84 0.00 0.00 0.00 174.94 173.51 2o5j s PRO 957 N 0.22 4.17 0.51 2.79 0.02 -1.26 -4.93 135.00 136.52 2o5j s PRO 957 Ca 0.44 1.57 0.31 0.00 0.02 0.00 0.00 61.00 63.34 2o5j s PRO 957 Cb -0.21 -2.59 1.13 0.00 0.02 0.00 0.00 34.50 32.85 2o5j s PRO 957 CO 0.26 -0.15 1.89 1.49 -0.33 0.00 0.00 177.00 180.16 2o5j h GLU 958 N 2.58 0.00 0.00 5.54 4.57 -1.98 -2.27 114.58 123.01 2o5j h GLU 958 Ca -0.48 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2o5j h GLU 958 Cb 1.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.81 2o5j h GLU 958 CO 0.62 0.00 0.00 1.05 -1.18 0.00 0.00 179.01 179.50 2o5j h GLU 959 N 0.00 0.00 -0.06 1.92 9.09 -1.99 -3.24 114.58 120.30 2o5j h GLU 959 Ca 0.00 0.00 0.04 0.00 0.05 0.00 0.00 59.36 59.45 2o5j h GLU 959 Cb 0.61 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 27.66 2o5j h GLU 959 CO 0.00 0.00 -0.26 -0.22 0.05 0.00 0.00 179.01 178.58 2o5j h LYS 960 N 0.00 -0.35 -0.86 1.06 3.64 -1.80 -0.09 116.57 118.17 2o5j h LYS 960 Ca 0.00 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.52 2o5j h LYS 960 Cb 0.62 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 32.45 2o5j h LYS 960 CO 0.00 -0.24 0.56 -0.22 -2.27 0.00 0.00 179.45 177.28 2o5j h LYS 961 N -0.37 0.73 0.17 1.90 3.64 -1.76 -1.61 116.57 119.27 2o5j h LYS 961 Ca 0.08 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2o5j h LYS 961 Cb 0.48 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2o5j h LYS 961 CO -0.27 0.48 -0.08 1.96 -2.27 0.00 0.00 179.45 179.28 2o5j h GLN 962 N 0.75 -0.21 -1.16 1.90 4.20 -1.47 -2.29 115.11 116.83 2o5j h GLN 962 Ca 0.41 0.01 0.33 0.00 0.06 0.00 0.00 58.65 59.47 2o5j h GLN 962 Cb 0.56 0.05 -0.10 0.00 0.30 0.00 0.00 27.48 28.28 2o5j h GLN 962 CO -0.18 -0.14 0.76 1.88 -0.67 0.00 0.00 178.83 180.48 2o5j h TYR 963 N -0.34 0.53 0.05 2.96 -1.99 -0.99 0.71 116.97 117.91 2o5j h TYR 963 Ca -0.02 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.72 2o5j h TYR 963 Cb 0.17 -0.15 0.00 0.00 2.00 0.00 0.00 36.73 38.76 2o5j h TYR 963 CO 0.10 -0.04 -0.03 1.25 -0.00 0.00 0.00 178.16 179.45 2o5j h LEU 964 N 0.24 -0.06 -0.32 3.88 6.46 -1.34 -1.77 115.31 122.41 2o5j h LEU 964 Ca 0.67 -0.33 -0.03 0.00 -0.12 0.00 0.00 57.88 58.08 2o5j h LEU 964 Cb 1.97 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 41.91 2o5j h LEU 964 CO -0.30 0.30 0.09 -0.08 -0.62 0.00 0.00 178.44 177.83 2o5j h GLU 965 N -0.43 0.50 -0.37 1.25 4.57 0.01 0.54 114.58 120.65 2o5j h GLU 965 Ca -0.01 -0.11 0.08 0.00 -1.18 0.00 0.00 59.36 58.14 2o5j h GLU 965 Cb 0.38 -0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 28.83 2o5j h GLU 965 CO 0.01 0.55 -0.12 0.93 -1.18 0.00 0.00 179.01 179.20 2o5j h GLU 966 N 0.35 -0.04 0.00 1.92 5.08 0.25 0.14 114.58 122.28 2o5j h GLU 966 Ca 0.10 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.34 2o5j h GLU 966 Cb 0.27 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2o5j h GLU 966 CO -0.00 -0.02 -0.59 0.00 -1.00 0.00 0.00 179.01 177.39 2o5j h ALA 967 N 1.31 0.96 0.55 3.43 0.00 -1.22 -2.74 119.26 121.55 2o5j h ALA 967 Ca 0.18 -0.54 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2o5j h ALA 967 Cb 0.32 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.02 2o5j h ALA 967 CO -0.40 0.74 -0.27 0.22 0.00 0.00 0.00 179.25 179.54 2o5j h ASP 968 N 0.00 -0.63 -0.73 0.00 1.82 0.19 -1.03 116.42 116.03 2o5j h ASP 968 Ca -0.01 -0.02 0.02 0.00 -0.39 0.00 0.00 57.03 56.63 2o5j h ASP 968 Cb 1.09 0.16 -0.04 0.00 0.68 0.00 0.00 39.33 41.22 2o5j h ASP 968 CO 0.08 -0.38 0.49 0.08 -1.61 0.00 0.00 179.24 177.89 2o5j h ARG 969 N -0.84 0.92 -0.13 0.28 0.11 -0.86 -0.85 114.38 113.01 2o5j h ARG 969 Ca -0.08 -0.06 -0.03 0.00 0.10 0.00 0.00 59.98 59.92 2o5j h ARG 969 Cb 0.61 -0.21 -0.01 0.00 1.11 0.00 0.00 29.97 31.47 2o5j h ARG 969 CO 0.12 0.61 -0.03 -0.22 0.10 0.00 0.00 179.97 180.55 2o5j h LYS 970 N 0.95 0.19 -0.84 0.08 3.64 -1.27 -1.44 116.57 117.88 2o5j h LYS 970 Ca 0.28 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 2o5j h LYS 970 Cb -0.04 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.70 2o5j h LYS 970 CO -0.07 0.24 0.50 1.37 -2.27 0.00 0.00 179.45 179.23 2o5j h LEU 971 N 0.19 1.01 -1.23 5.20 8.10 0.21 -2.06 115.31 126.74 2o5j h LEU 971 Ca 0.04 -0.07 -0.07 0.00 0.11 0.00 0.00 57.88 57.89 2o5j h LEU 971 Cb 0.19 -0.26 -0.01 0.00 -0.44 0.00 0.00 40.66 40.14 2o5j h LEU 971 CO 0.01 0.78 -0.29 -0.07 -4.11 0.00 0.00 178.44 174.76 2o5j h LEU 972 N 1.16 0.15 -0.19 0.17 -0.00 -1.09 -1.40 115.31 114.11 2o5j h LEU 972 Ca 0.30 -0.05 -0.02 0.00 -0.00 0.00 0.00 57.88 58.12 2o5j h LEU 972 Cb -0.04 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 40.57 2o5j h LEU 972 CO -0.06 0.45 0.05 1.56 -0.00 0.00 0.00 178.44 180.44 2o5j h GLN 973 N 0.14 0.30 0.00 1.13 4.20 -0.85 -0.59 115.11 119.44 2o5j h GLN 973 Ca 0.02 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 2o5j h GLN 973 Cb 0.59 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.32 2o5j h GLN 973 CO 0.04 0.42 -0.13 0.82 -0.67 0.00 0.00 178.83 179.32 2o5j h ILE 974 N 0.12 1.03 -0.00 2.54 2.04 -1.09 0.11 117.51 122.26 2o5j h ILE 974 Ca 0.06 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 2o5j h ILE 974 Cb 0.25 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 2o5j h ILE 974 CO -0.00 0.13 -0.04 -0.08 0.00 0.00 0.00 178.15 178.16 2o5j h GLU 975 N 0.00 0.03 -0.43 2.37 4.22 -0.95 -2.61 114.58 117.21 2o5j h GLU 975 Ca -0.00 -0.03 0.02 0.00 0.08 0.00 0.00 59.36 59.43 2o5j h GLU 975 Cb 0.24 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2o5j h GLU 975 CO 0.02 0.77 0.29 1.96 -2.18 0.00 0.00 179.01 179.86 2o5j h GLN 976 N -0.70 0.49 0.00 1.92 4.20 -0.83 0.62 115.11 120.81 2o5j h GLN 976 Ca -0.00 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2o5j h GLN 976 Cb 0.78 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.45 2o5j h GLN 976 CO 0.01 0.32 -0.05 0.00 -0.67 0.00 0.00 178.83 178.44 2o5j h ALA 977 N 1.75 1.03 0.04 3.87 0.00 -0.79 -2.94 119.26 122.23 2o5j h ALA 977 Ca 0.17 -0.04 -0.32 0.00 0.00 0.00 0.00 54.91 54.72 2o5j h ALA 977 Cb 0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 2o5j h ALA 977 CO -0.04 0.06 -1.76 0.98 0.00 0.00 0.00 179.25 178.49 2o5j n TYR 978 N -3.19 0.91 0.20 0.00 9.36 0.67 -2.67 117.16 122.44 2o5j n TYR 978 Ca -0.00 0.30 0.12 0.00 3.32 0.00 0.00 57.90 61.64 2o5j n TYR 978 Cb 0.28 -1.10 0.65 0.00 -0.63 0.00 0.00 39.34 38.54 2o5j n TYR 978 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 2o5j h GLU 979 N -0.56 0.00 0.00 2.98 5.08 0.12 -1.22 114.58 120.98 2o5j h GLU 979 Ca -0.44 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 57.64 2o5j h GLU 979 Cb 1.64 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.84 2o5j h GLU 979 CO -0.13 0.00 -1.91 -1.33 -1.00 0.00 0.00 179.01 174.65 2o5j n MET 980 N -2.38 0.65 0.00 2.33 2.81 -1.12 -5.01 117.12 114.41 2o5j n MET 980 Ca -0.02 0.15 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 2o5j n MET 980 Cb 0.11 -1.69 0.00 0.00 -0.71 0.00 0.00 33.22 30.94 2o5j n MET 980 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2o5j n GLY 981 N 1.58 1.22 0.23 3.03 0.00 -0.46 -5.05 105.19 105.74 2o5j n GLY 981 Ca -0.21 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 2o5j n GLY 981 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2o5j h PHE 982 N 0.00 -0.47 -3.40 1.61 0.05 -1.72 -3.45 116.94 109.56 2o5j h PHE 982 Ca 0.00 -0.01 -0.55 0.00 3.82 0.00 0.00 57.97 61.23 2o5j h PHE 982 Cb 0.00 0.16 -0.04 0.00 2.00 0.00 0.00 35.95 38.06 2o5j h PHE 982 CO 0.00 -0.20 0.14 -0.51 -0.18 0.00 0.00 178.31 177.56 2o5j s LEU 983 N -9.18 4.40 0.72 1.54 1.43 -1.20 -5.06 118.68 111.34 2o5j s LEU 983 Ca -0.10 1.37 -0.13 0.00 -1.03 0.00 0.00 54.13 54.24 2o5j s LEU 983 Cb 0.01 -3.20 0.03 0.00 0.03 0.00 0.00 46.19 43.06 2o5j s LEU 983 CO 0.34 -0.04 1.10 0.28 0.23 0.00 0.00 176.35 178.26 2o5j s THR 984 N 0.27 3.27 0.38 5.49 -1.32 -1.26 -4.74 115.64 117.71 2o5j s THR 984 Ca 0.39 0.49 0.21 0.00 -1.21 0.00 0.00 61.69 61.57 2o5j s THR 984 Cb -0.20 -2.99 0.37 0.00 -1.51 0.00 0.00 72.50 68.17 2o5j s THR 984 CO 0.22 -0.46 1.62 -0.78 -2.21 0.00 0.00 174.62 173.01 2o5j h ASP 985 N -0.58 0.38 0.17 8.08 3.58 -1.99 -1.38 116.42 124.67 2o5j h ASP 985 Ca -0.45 0.21 -0.01 0.00 0.42 0.00 0.00 57.03 57.20 2o5j h ASP 985 Cb 1.24 0.19 0.00 0.00 1.72 0.00 0.00 39.33 42.48 2o5j h ASP 985 CO 0.52 -0.27 -0.08 -0.09 -2.88 0.00 0.00 179.24 176.44 2o5j h ARG 986 N 0.14 -0.22 -1.00 0.28 9.65 -2.01 -3.26 114.38 117.96 2o5j h ARG 986 Ca 0.80 0.02 0.41 0.00 -1.10 0.00 0.00 59.98 60.11 2o5j h ARG 986 Cb 2.11 0.05 -0.17 0.00 -1.39 0.00 0.00 29.97 30.57 2o5j h ARG 986 CO -0.63 -0.15 0.56 0.39 2.80 0.00 0.00 179.97 182.94 2o5j n GLU 987 N -3.82 -0.06 0.15 0.20 1.02 -0.77 0.52 120.64 117.88 2o5j n GLU 987 Ca -0.03 1.32 -0.16 0.00 -0.02 0.00 0.00 57.16 58.27 2o5j n GLU 987 Cb 0.09 -2.40 -0.09 0.00 -0.02 0.00 0.00 31.44 29.03 2o5j n GLU 987 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2o5j h ARG 988 N 0.00 -0.75 0.59 3.49 2.43 -1.37 0.01 114.38 118.77 2o5j h ARG 988 Ca 0.82 0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 60.02 2o5j h ARG 988 Cb 2.23 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 31.94 2o5j h ARG 988 CO -0.71 -0.50 -0.43 -0.92 -1.51 0.00 0.00 179.97 175.90 2o5j h TYR 989 N -0.78 -1.17 -0.95 2.20 3.20 0.03 -1.09 116.97 118.41 2o5j h TYR 989 Ca -0.01 -0.00 0.23 0.00 3.14 0.00 0.00 58.73 62.09 2o5j h TYR 989 Cb 0.76 0.43 -0.07 0.00 1.54 0.00 0.00 36.73 39.39 2o5j h TYR 989 CO -0.38 -0.62 0.63 -0.44 -1.64 0.00 0.00 178.16 175.72 2o5j h ASP 990 N -0.98 0.36 0.07 -2.11 5.19 -1.29 -0.37 116.42 117.30 2o5j h ASP 990 Ca -0.08 0.05 -0.27 0.00 -0.62 0.00 0.00 57.03 56.11 2o5j h ASP 990 Cb 0.81 -0.02 0.02 0.00 0.18 0.00 0.00 39.33 40.32 2o5j h ASP 990 CO 0.03 0.12 -1.08 -0.61 -3.12 0.00 0.00 179.24 174.59 2o5j h GLN 991 N 0.35 0.66 -0.19 3.56 -0.00 -0.76 -2.96 115.11 115.76 2o5j h GLN 991 Ca 0.50 -0.74 -0.00 0.00 -0.00 0.00 0.00 58.65 58.41 2o5j h GLN 991 Cb 1.36 0.22 -0.01 0.00 0.00 0.00 0.00 27.48 29.05 2o5j h GLN 991 CO -0.19 1.32 0.11 0.82 0.00 0.00 0.00 178.83 180.89 2o5j h ILE 992 N 0.35 1.09 -0.47 2.39 2.04 0.23 -2.48 117.51 120.66 2o5j h ILE 992 Ca -0.14 -0.21 0.08 0.00 1.00 0.00 0.00 64.86 65.59 2o5j h ILE 992 Cb 1.73 0.89 -0.07 0.00 -0.74 0.00 0.00 36.82 38.63 2o5j h ILE 992 CO 0.21 0.08 0.07 -0.07 0.00 0.00 0.00 178.15 178.44 2o5j h LEU 993 N 0.22 -0.04 -1.42 1.44 3.38 -1.43 -1.30 115.31 116.16 2o5j h LEU 993 Ca 0.07 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 2o5j h LEU 993 Cb 0.03 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2o5j h LEU 993 CO -0.01 0.01 0.32 -0.61 0.09 0.00 0.00 178.44 178.24 2o5j h GLN 994 N 0.20 0.71 -0.37 1.13 5.75 -1.36 0.15 115.11 121.32 2o5j h GLN 994 Ca 0.23 -0.06 0.01 0.00 -0.15 0.00 0.00 58.65 58.69 2o5j h GLN 994 Cb 0.32 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.69 2o5j h GLN 994 CO -0.32 0.50 0.23 1.25 -2.65 0.00 0.00 178.83 177.83 2o5j h LEU 995 N 0.73 0.39 0.01 -2.39 5.85 -0.77 -2.29 115.31 116.83 2o5j h LEU 995 Ca 0.19 -0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.76 2o5j h LEU 995 Cb -0.03 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 40.92 2o5j h LEU 995 CO -0.04 0.28 -0.58 -0.50 -0.34 0.00 0.00 178.44 177.26 2o5j h TRP 996 N 0.47 0.57 -1.10 1.25 -0.00 -1.22 -0.86 115.95 115.06 2o5j h TRP 996 Ca 0.14 -0.32 0.31 0.00 -0.00 0.00 0.00 58.89 59.02 2o5j h TRP 996 Cb -0.03 -0.06 -0.11 0.00 -0.00 0.00 0.00 29.16 28.96 2o5j h TRP 996 CO -0.06 1.14 0.70 1.15 -0.00 0.00 0.00 178.44 181.37 2o5j h THR 997 N -0.16 0.41 0.02 1.49 2.02 -0.64 0.72 112.91 116.77 2o5j h THR 997 Ca -0.08 -0.11 -0.15 0.00 0.77 0.00 0.00 66.41 66.85 2o5j h THR 997 Cb 1.31 0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 2o5j h THR 997 CO 0.11 0.06 -0.79 -0.08 0.37 0.00 0.00 175.52 175.19 2o5j h GLU 998 N 0.32 0.04 -0.99 6.66 4.81 -1.42 -3.19 114.58 120.81 2o5j h GLU 998 Ca 0.66 -0.07 0.09 0.00 -0.13 0.00 0.00 59.36 59.91 2o5j h GLU 998 Cb 1.76 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 31.09 2o5j h GLU 998 CO -0.36 1.03 0.63 1.15 -0.73 0.00 0.00 179.01 180.74 2o5j h THR 999 N -0.89 1.00 0.26 0.32 2.02 0.00 0.22 112.91 115.85 2o5j h THR 999 Ca -0.20 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 2o5j h THR 999 Cb 1.26 -0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 2o5j h THR 999 CO -0.08 0.19 -0.12 0.00 0.37 0.00 0.00 175.52 175.88 2o5j h THR 1000N 1.06 0.79 -0.33 3.16 1.03 0.25 -1.31 112.91 117.57 2o5j h THR 1000Ca 0.46 -0.42 0.10 0.00 -0.01 0.00 0.00 66.41 66.53 2o5j h THR 1000Cb 0.34 1.03 -0.01 0.00 -1.07 0.00 0.00 68.15 68.44 2o5j h THR 1000CO -0.21 0.09 0.31 -0.08 -0.01 0.00 0.00 175.52 175.62 2o5j h GLU 1001N -0.57 0.00 -0.07 0.00 4.22 -1.38 0.22 114.58 117.00 2o5j h GLU 1001Ca -0.04 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.36 2o5j h GLU 1001Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2o5j h GLU 1001CO 0.06 0.00 -0.12 0.87 -2.18 0.00 0.00 179.01 177.64 2o5j h LYS 1002N 0.00 0.20 -0.10 1.92 1.57 -0.09 -3.02 116.57 117.05 2o5j h LYS 1002Ca 0.16 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 2o5j h LYS 1002Cb 0.78 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 2o5j h LYS 1002CO -0.00 0.71 -0.09 -0.24 -0.57 0.00 0.00 179.45 179.25 2o5j h VAL 1003N -0.28 1.13 0.00 0.50 3.04 0.15 -2.30 116.25 118.50 2o5j h VAL 1003Ca 0.00 -0.56 0.00 0.00 -1.01 0.00 0.00 66.70 65.13 2o5j h VAL 1003Cb 0.69 1.16 0.00 0.00 -2.01 0.00 0.00 31.29 31.14 2o5j h VAL 1003CO 0.03 0.17 0.00 0.41 -1.01 0.00 0.00 177.57 177.17 2o5j n THR 1004N -4.35 0.00 -0.06 3.17 -1.04 -0.56 -0.84 114.28 110.61 2o5j n THR 1004Ca -0.01 1.41 0.17 0.00 -2.04 0.00 0.00 64.05 63.58 2o5j n THR 1004Cb 0.22 -2.23 0.60 0.00 -1.82 0.00 0.00 70.33 67.09 2o5j n THR 1004CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 2o5j h GLN 1005N 0.00 0.19 0.84 -2.82 5.75 -1.54 -2.32 115.11 115.22 2o5j h GLN 1005Ca 0.00 -0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.45 2o5j h GLN 1005Cb 0.00 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.51 2o5j h GLN 1005CO 0.00 0.13 -0.47 0.00 -2.65 0.00 0.00 178.83 175.84 2o5j h ALA 1006N 1.71 -1.30 -0.78 3.38 0.00 -1.06 0.33 119.26 121.55 2o5j h ALA 1006Ca 0.29 -0.26 0.17 0.00 0.00 0.00 0.00 54.91 55.11 2o5j h ALA 1006Cb 0.86 0.56 -0.11 0.00 0.00 0.00 0.00 17.79 19.10 2o5j h ALA 1006CO -0.05 -1.23 0.26 0.28 0.00 0.00 0.00 179.25 178.50 2o5j h VAL 1007N -1.22 0.54 -0.53 0.00 2.07 -0.44 0.28 116.25 116.95 2o5j h VAL 1007Ca -0.11 -0.12 -0.09 0.00 0.82 0.00 0.00 66.70 67.19 2o5j h VAL 1007Cb 0.96 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2o5j h VAL 1007CO 0.14 0.06 -0.03 -0.26 0.02 0.00 0.00 177.57 177.50 2o5j h PHE 1008N 0.35 1.05 -0.74 1.57 0.05 -1.34 -2.59 116.94 115.30 2o5j h PHE 1008Ca 0.45 -0.20 0.07 0.00 3.82 0.00 0.00 57.97 62.11 2o5j h PHE 1008Cb 0.76 -0.27 -0.05 0.00 2.00 0.00 0.00 35.95 38.39 2o5j h PHE 1008CO -0.21 0.97 0.48 0.87 -0.18 0.00 0.00 178.31 180.25 2o5j h LYS 1009N 0.83 0.72 0.39 1.51 1.57 0.31 0.59 116.57 122.49 2o5j h LYS 1009Ca 0.15 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 2o5j h LYS 1009Cb 0.58 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2o5j h LYS 1009CO 0.03 0.47 -0.19 -0.97 -0.57 0.00 0.00 179.45 178.23 2o5j h ASN 1010N 0.74 -0.44 0.03 0.86 -0.73 -0.57 -2.41 115.58 113.05 2o5j h ASN 1010Ca 0.32 -0.04 0.02 0.00 1.87 0.00 0.00 56.30 58.47 2o5j h ASN 1010Cb 0.31 0.11 -0.02 0.00 0.27 0.00 0.00 38.32 38.99 2o5j h ASN 1010CO -0.11 -0.25 -0.13 -0.26 -0.37 0.00 0.00 177.43 176.31 2o5j h PHE 1011N -0.61 -0.34 -0.64 0.67 0.04 -1.10 0.37 116.94 115.33 2o5j h PHE 1011Ca -0.05 0.01 0.13 0.00 2.80 0.00 0.00 57.97 60.86 2o5j h PHE 1011Cb 0.45 0.15 -0.11 0.00 2.20 0.00 0.00 35.95 38.64 2o5j h PHE 1011CO -0.03 -0.20 -0.02 1.49 -0.60 0.00 0.00 178.31 178.96 2o5j h GLU 1012N -0.24 0.10 0.03 1.51 4.81 -0.88 0.43 114.58 120.34 2o5j h GLU 1012Ca 0.04 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 59.05 2o5j h GLU 1012Cb 0.28 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 2o5j h GLU 1012CO -0.11 0.07 -1.15 0.93 -0.73 0.00 0.00 179.01 178.02 2o5j h GLU 1013N 0.10 0.06 0.00 1.92 5.08 -1.30 -3.42 114.58 117.02 2o5j h GLU 1013Ca 0.33 -0.10 -0.11 0.00 -1.00 0.00 0.00 59.36 58.48 2o5j h GLU 1013Cb 0.54 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 2o5j h GLU 1013CO -0.56 1.05 -0.87 0.09 -1.00 0.00 0.00 179.01 177.72 2o5j n ASN 1014N -4.31 1.83 -4.03 1.42 3.02 0.13 -4.72 115.26 108.61 2o5j n ASN 1014Ca -0.28 0.54 -0.35 0.00 -0.03 0.00 0.00 54.58 54.46 2o5j n ASN 1014Cb 0.71 -0.91 -0.07 0.00 -0.61 0.00 0.00 39.78 38.90 2o5j n ASN 1014CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2o5j n TYR 1015N -4.53 3.99 0.05 3.10 4.01 0.10 -4.89 117.16 118.98 2o5j n TYR 1015Ca -0.19 -4.06 0.06 0.00 -0.16 0.00 0.00 57.90 53.56 2o5j n TYR 1015Cb 0.46 -1.06 0.48 0.00 -0.31 0.00 0.00 39.34 38.91 2o5j n TYR 1015CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2o5j h PRO 1016N 5.75 0.40 -2.30 -0.72 0.11 -1.70 -3.00 132.00 130.53 2o5j h PRO 1016Ca 0.17 -0.02 -0.67 0.00 0.11 0.00 0.00 66.00 65.59 2o5j h PRO 1016Cb 0.78 -0.09 -0.37 0.00 0.11 0.00 0.00 31.00 31.43 2o5j h PRO 1016CO 0.88 0.26 -0.08 1.19 -0.21 0.00 0.00 178.00 180.04 2o5j n PHE 1017N -4.49 3.56 -2.86 0.65 3.01 -1.26 -4.80 117.46 111.27 2o5j n PHE 1017Ca 0.03 -3.53 -0.42 0.00 1.01 0.00 0.00 57.45 54.54 2o5j n PHE 1017Cb 0.11 -0.74 -0.04 0.00 -0.01 0.00 0.00 39.48 38.80 2o5j n PHE 1017CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 2o5j s ASN 1018N -2.68 6.97 0.33 4.37 3.84 -1.13 -4.95 114.94 121.69 2o5j s ASN 1018Ca 0.44 1.20 0.09 0.00 0.21 0.00 0.00 52.86 54.80 2o5j s ASN 1018Cb 0.23 -2.47 0.97 0.00 -0.55 0.00 0.00 41.25 39.43 2o5j s ASN 1018CO -0.11 -0.44 1.60 -0.65 -2.79 0.00 0.00 177.10 174.72 2o5j h PRO 1019N 7.37 0.09 -0.23 0.43 0.11 -1.91 -1.03 132.00 136.82 2o5j h PRO 1019Ca -0.28 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.71 2o5j h PRO 1019Cb 1.12 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2o5j h PRO 1019CO 0.85 0.06 -0.31 1.25 -0.21 0.00 0.00 178.00 179.64 2o5j h LEU 1020N 0.09 0.66 -0.15 2.35 5.85 -1.89 -3.35 115.31 118.88 2o5j h LEU 1020Ca 0.68 -0.51 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 2o5j h LEU 1020Cb 1.57 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 2o5j h LEU 1020CO -0.78 1.04 -0.00 0.22 -0.34 0.00 0.00 178.44 178.58 2o5j h TYR 1021N 0.30 0.29 -0.98 1.25 5.03 -1.60 -3.28 116.97 117.99 2o5j h TYR 1021Ca 0.03 -0.05 0.08 0.00 2.58 0.00 0.00 58.73 61.36 2o5j h TYR 1021Cb 0.89 -0.08 -0.07 0.00 1.55 0.00 0.00 36.73 39.02 2o5j h TYR 1021CO 0.08 0.50 0.63 0.28 -1.32 0.00 0.00 178.16 178.33 2o5j h VAL 1022N 0.00 1.04 -0.85 1.81 2.07 -1.59 -2.66 116.25 116.07 2o5j h VAL 1022Ca 0.04 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 2o5j h VAL 1022Cb 0.38 -0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 29.97 2o5j h VAL 1022CO 0.01 0.20 0.51 0.24 0.02 0.00 0.00 177.57 178.55 2o5j h MET 1023N 1.09 1.16 -0.05 1.57 2.86 -1.71 -0.89 114.93 118.97 2o5j h MET 1023Ca 0.44 -0.11 -0.01 0.00 -2.06 0.00 0.00 59.70 57.95 2o5j h MET 1023Cb 0.26 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 2o5j h MET 1023CO -0.19 0.82 -0.01 0.00 1.06 0.00 0.00 176.91 178.59 2o5j h ALA 1024N 1.27 0.06 0.31 6.32 0.00 -0.34 -0.20 119.26 126.69 2o5j h ALA 1024Ca 0.31 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2o5j h ALA 1024Cb -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2o5j h ALA 1024CO -0.06 -0.22 -0.15 0.37 0.00 0.00 0.00 179.25 179.20 2o5j h GLN 1025N -0.27 -0.40 -7.15 0.00 5.75 -1.47 -3.41 115.11 108.16 2o5j h GLN 1025Ca 0.01 0.03 -0.55 0.00 -0.15 0.00 0.00 58.65 57.99 2o5j h GLN 1025Cb 0.41 0.09 0.17 0.00 1.07 0.00 0.00 27.48 29.23 2o5j h GLN 1025CO 0.01 -0.20 0.39 0.43 -2.65 0.00 0.00 178.83 176.80 2o5j n SER 1026N -5.23 1.40 0.00 -0.69 7.64 -0.34 -4.66 113.62 111.74 2o5j n SER 1026Ca -0.10 0.68 0.01 0.00 1.01 0.00 0.00 58.87 60.47 2o5j n SER 1026Cb 0.21 -1.52 0.03 0.00 -1.01 0.00 0.00 64.21 61.92 2o5j n SER 1026CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2o5j n GLY 1027N 0.73 -0.30 0.00 0.23 0.00 -1.26 -4.34 105.19 100.24 2o5j n GLY 1027Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2o5j n GLY 1027CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j n ALA 1028N -0.56 0.00 -2.48 4.61 0.00 -1.10 -4.46 120.51 116.53 2o5j n ALA 1028Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.33 2o5j n ALA 1028Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.35 2o5j n ALA 1028CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2o5j s ARG 1029N 0.00 0.72 0.00 0.00 1.81 -0.10 -4.16 118.95 117.21 2o5j s ARG 1029Ca 0.00 -1.09 0.00 0.00 -1.72 0.00 0.00 55.73 52.92 2o5j s ARG 1029Cb 0.00 -0.28 0.00 0.00 -0.45 0.00 0.00 34.95 34.22 2o5j s ARG 1029CO 0.00 0.02 0.00 0.41 -0.68 0.00 0.00 175.30 175.05 2o5j n GLY 1030N 0.62 3.28 2.86 -3.53 0.00 -1.26 -0.34 105.19 106.82 2o5j n GLY 1030Ca -0.17 -1.80 -0.16 0.00 0.00 0.00 0.00 46.02 43.89 2o5j n GLY 1030CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2o5j s ASN 1031N 0.00 0.43 0.30 1.61 3.84 -1.26 -4.79 114.94 115.07 2o5j s ASN 1031Ca 0.00 -0.04 0.05 0.00 0.21 0.00 0.00 52.86 53.08 2o5j s ASN 1031Cb 0.00 -0.18 0.78 0.00 -0.55 0.00 0.00 41.25 41.30 2o5j s ASN 1031CO 0.00 -0.05 1.69 -0.65 -2.79 0.00 0.00 177.10 175.30 2o5j h PRO 1032N 6.87 0.37 0.00 0.43 0.11 -1.99 0.36 132.00 138.16 2o5j h PRO 1032Ca -0.38 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.63 2o5j h PRO 1032Cb 1.15 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2o5j h PRO 1032CO 0.49 0.25 -0.39 0.37 -0.21 0.00 0.00 178.00 178.50 2o5j h GLN 1033N 0.38 0.00 0.39 1.05 4.15 -1.98 -3.04 115.11 116.06 2o5j h GLN 1033Ca 0.59 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.99 2o5j h GLN 1033Cb 1.15 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.85 2o5j h GLN 1033CO -0.55 0.39 -0.19 1.96 -1.93 0.00 0.00 178.83 178.52 2o5j h GLN 1034N 0.00 -0.50 -1.05 1.69 4.20 -0.72 -3.21 115.11 115.51 2o5j h GLN 1034Ca -0.00 0.03 0.29 0.00 0.06 0.00 0.00 58.65 59.03 2o5j h GLN 1034Cb 0.85 0.11 -0.06 0.00 0.30 0.00 0.00 27.48 28.69 2o5j h GLN 1034CO 0.05 -0.33 0.73 0.82 -0.67 0.00 0.00 178.83 179.43 2o5j h ILE 1035N -1.04 0.49 -0.75 2.54 1.08 -1.15 0.29 117.51 118.98 2o5j h ILE 1035Ca -0.05 -0.06 -0.03 0.00 -0.39 0.00 0.00 64.86 64.33 2o5j h ILE 1035Cb 0.40 0.32 -0.03 0.00 -3.07 0.00 0.00 36.82 34.43 2o5j h ILE 1035CO 0.09 0.03 0.34 -0.09 -0.69 0.00 0.00 178.15 177.83 2o5j h ARG 1036N 0.16 1.08 0.00 2.37 2.43 -1.58 -1.90 114.38 116.95 2o5j h ARG 1036Ca 0.54 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 2o5j h ARG 1036Cb 1.81 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 31.17 2o5j h ARG 1036CO -0.12 0.85 0.00 1.04 -1.51 0.00 0.00 179.97 180.23 2o5j n GLN 1037N -4.31 0.21 -0.12 0.20 6.02 0.10 -0.32 117.38 119.16 2o5j n GLN 1037Ca 0.07 0.41 -0.23 0.00 -0.01 0.00 0.00 57.00 57.24 2o5j n GLN 1037Cb 0.15 -1.88 -0.08 0.00 1.02 0.00 0.00 30.24 29.45 2o5j n GLN 1037CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2o5j n LEU 1038N -2.27 1.93 -0.11 1.08 4.77 -0.88 -0.34 117.00 121.18 2o5j n LEU 1038Ca 0.02 0.37 -0.25 0.00 -0.03 0.00 0.00 56.01 56.12 2o5j n LEU 1038Cb 0.25 -0.83 -0.11 0.00 -2.33 0.00 0.00 43.42 40.40 2o5j n LEU 1038CO 0.21 0.29 -1.13 0.00 -1.33 0.00 0.00 177.39 175.43 2o5j n GLY 1040N 1.56 0.26 3.40 0.00 0.00 -0.17 -4.54 105.19 105.70 2o5j n GLY 1040Ca -0.45 -0.08 -0.10 0.00 0.00 0.00 0.00 46.02 45.39 2o5j n GLY 1040CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2o5j s LEU 1041N 0.00 -0.34 -0.30 0.99 2.34 0.56 -4.18 118.68 117.75 2o5j s LEU 1041Ca 0.00 1.10 -0.29 0.00 0.06 0.00 0.00 54.13 55.00 2o5j s LEU 1041Cb 0.00 1.70 0.01 0.00 -0.56 0.00 0.00 46.19 47.34 2o5j s LEU 1041CO 0.00 -0.21 1.24 0.00 -1.06 0.00 0.00 176.35 176.32 2o5j s ARG 1042N 1.37 3.96 -0.20 1.48 1.70 -1.21 -4.69 118.95 121.36 2o5j s ARG 1042Ca -0.09 1.20 -0.06 0.00 -0.47 0.00 0.00 55.73 56.31 2o5j s ARG 1042Cb -0.07 -3.84 -0.20 0.00 -0.57 0.00 0.00 34.95 30.27 2o5j s ARG 1042CO -0.14 -1.06 0.03 0.41 -1.08 0.00 0.00 175.30 173.47 2o5j n GLY 1043N 4.19 -0.50 3.03 3.88 0.00 -1.26 -4.00 105.19 110.53 2o5j n GLY 1043Ca 0.14 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 2o5j n GLY 1043CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2o5j s LEU 1044N -6.97 1.88 -0.26 0.99 0.20 -1.26 0.46 118.68 113.71 2o5j s LEU 1044Ca -0.30 -0.59 -0.03 0.00 0.69 0.00 0.00 54.13 53.90 2o5j s LEU 1044Cb 0.08 -1.23 0.02 0.00 -0.43 0.00 0.00 46.19 44.63 2o5j s LEU 1044CO 0.65 -0.07 -0.02 -0.04 -0.29 0.00 0.00 176.35 176.58 2o5j s MET 1045N 1.44 2.85 0.89 1.98 -1.94 -1.26 -4.70 119.30 118.56 2o5j s MET 1045Ca 0.04 -0.98 -0.10 0.00 -1.71 0.00 0.00 55.69 52.94 2o5j s MET 1045Cb -0.14 -3.10 0.13 0.00 2.01 0.00 0.00 34.83 33.74 2o5j s MET 1045CO -0.10 -0.43 1.13 -0.65 -0.01 0.00 0.00 175.02 174.95 2o5j s GLN 1046N 1.36 1.23 1.15 2.03 -0.21 -1.26 -3.40 119.66 120.56 2o5j s GLN 1046Ca 0.00 1.44 -0.19 0.00 0.02 0.00 0.00 55.36 56.64 2o5j s GLN 1046Cb -0.17 -1.76 0.27 0.00 1.00 0.00 0.00 33.01 32.35 2o5j s GLN 1046CO -0.02 -2.45 1.18 0.15 -2.12 0.00 0.00 175.29 172.02 2o5j s LYS 1047N -4.70 -0.84 0.13 2.91 1.02 -0.84 -4.67 119.74 112.75 2o5j s LYS 1047Ca 0.66 -0.23 -0.22 0.00 0.02 0.00 0.00 55.97 56.19 2o5j s LYS 1047Cb -0.22 -1.66 -0.02 0.00 -0.52 0.00 0.00 37.83 35.42 2o5j s LYS 1047CO 0.58 -3.43 1.66 -1.35 -0.92 0.00 0.00 175.35 171.89 2o5j h PRO 1048N -2.38 -0.21 0.00 -1.68 0.11 -1.94 -3.27 132.00 122.64 2o5j h PRO 1048Ca -0.44 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2o5j h PRO 1048Cb 1.27 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2o5j h PRO 1048CO 0.32 -0.14 0.00 -1.13 -0.21 0.00 0.00 178.00 176.85 2o5j n SER 1049N -5.31 0.00 0.00 -2.05 3.41 -1.26 -4.93 113.62 103.48 2o5j n SER 1049Ca -0.03 0.87 0.00 0.00 -0.26 0.00 0.00 58.87 59.45 2o5j n SER 1049Cb 0.23 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 2o5j n SER 1049CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2o5j n GLY 1050N -0.91 0.09 3.61 5.00 0.00 -1.23 -5.10 105.19 106.64 2o5j n GLY 1050Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2o5j n GLY 1050CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o5j s GLU 1051N 0.00 3.31 0.77 1.61 2.12 -1.26 -4.59 118.70 120.66 2o5j s GLU 1051Ca 0.00 2.06 -0.15 0.00 0.36 0.00 0.00 54.97 57.24 2o5j s GLU 1051Cb 0.00 -4.32 0.04 0.00 0.26 0.00 0.00 34.13 30.11 2o5j s GLU 1051CO 0.00 -1.90 1.04 0.25 -0.54 0.00 0.00 175.26 174.11 2o5j n THR 1052N 7.37 2.33 -2.35 -1.70 -2.24 -1.26 -1.98 114.28 114.45 2o5j n THR 1052Ca 0.28 -0.29 -0.36 0.00 -2.27 0.00 0.00 64.05 61.41 2o5j n THR 1052Cb 0.45 -1.12 -0.01 0.00 -2.10 0.00 0.00 70.33 67.54 2o5j n THR 1052CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2o5j s PHE 1053N -1.98 2.87 0.25 4.78 0.40 -1.22 -4.68 117.98 118.40 2o5j s PHE 1053Ca 0.72 1.56 0.01 0.00 -0.60 0.00 0.00 56.93 58.62 2o5j s PHE 1053Cb -0.31 -3.26 0.30 0.00 0.51 0.00 0.00 43.02 40.26 2o5j s PHE 1053CO 0.51 -1.30 1.64 1.05 0.70 0.00 0.00 175.22 177.82 2o5j h GLU 1054N 1.71 0.47 -5.80 0.44 4.11 -1.93 -3.43 114.58 110.16 2o5j h GLU 1054Ca -0.49 -0.23 -0.61 0.00 0.07 0.00 0.00 59.36 58.10 2o5j h GLU 1054Cb 1.24 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.42 2o5j h GLU 1054CO 0.59 0.78 -0.28 0.08 0.07 0.00 0.00 179.01 180.26 2o5j s VAL 1055N -4.26 5.20 0.75 -1.06 1.01 -1.26 -4.95 120.40 115.82 2o5j s VAL 1055Ca -0.07 0.66 -0.02 0.00 0.00 0.00 0.00 61.98 62.56 2o5j s VAL 1055Cb 0.13 -3.64 0.14 0.00 0.00 0.00 0.00 36.38 33.00 2o5j s VAL 1055CO 0.81 0.52 1.03 -2.84 0.00 0.00 0.00 175.10 174.62 2o5j s PRO 1056N -0.56 1.53 -0.95 2.72 0.02 -1.26 -4.77 135.00 131.73 2o5j s PRO 1056Ca 0.21 -1.09 -0.06 0.00 0.02 0.00 0.00 61.00 60.07 2o5j s PRO 1056Cb -0.15 -2.28 0.24 0.00 0.02 0.00 0.00 34.50 32.32 2o5j s PRO 1056CO 0.09 -1.58 0.88 0.08 -0.33 0.00 0.00 177.00 176.14 2o5j s VAL 1057N -3.22 5.06 0.18 3.83 1.01 0.17 -4.93 120.40 122.50 2o5j s VAL 1057Ca 0.68 -3.49 0.14 0.00 0.00 0.00 0.00 61.98 59.31 2o5j s VAL 1057Cb -0.05 -4.10 0.14 0.00 0.00 0.00 0.00 36.38 32.37 2o5j s VAL 1057CO 0.45 -1.10 1.34 0.03 0.00 0.00 0.00 175.10 175.82 2o5j h ARG 1058N 6.52 0.00 -6.47 2.72 3.08 -1.85 -3.37 114.38 115.00 2o5j h ARG 1058Ca 0.15 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.75 2o5j h ARG 1058Cb 0.87 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.93 2o5j h ARG 1058CO 0.89 0.00 -0.24 -1.54 -1.07 0.00 0.00 179.97 178.01 2o5j s SER 1059N -3.48 5.94 0.52 7.04 1.04 -1.26 -4.89 113.70 118.60 2o5j s SER 1059Ca -0.02 0.03 0.06 0.00 0.48 0.00 0.00 55.95 56.51 2o5j s SER 1059Cb 0.04 -1.41 0.02 0.00 0.10 0.00 0.00 66.02 64.77 2o5j s SER 1059CO 0.13 -0.52 0.37 -0.44 0.98 0.00 0.00 173.24 173.76 2o5j s SER 1060N -4.18 4.64 0.05 7.02 0.01 -1.26 -3.29 113.70 116.69 2o5j s SER 1060Ca 0.46 -1.19 0.26 0.00 1.31 0.00 0.00 55.95 56.78 2o5j s SER 1060Cb -0.10 0.24 0.70 0.00 0.21 0.00 0.00 66.02 67.07 2o5j s SER 1060CO 0.34 -1.00 1.57 0.49 0.41 0.00 0.00 173.24 175.05 2o5j n PHE 1061N -1.68 0.24 0.35 2.43 3.01 0.54 -3.77 117.46 118.58 2o5j n PHE 1061Ca -0.02 0.07 -0.17 0.00 1.01 0.00 0.00 57.45 58.34 2o5j n PHE 1061Cb 0.64 -0.49 -0.09 0.00 -0.01 0.00 0.00 39.48 39.53 2o5j n PHE 1061CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 2o5j h ARG 1062N 0.00 -0.82 -6.49 -1.08 1.12 -1.67 -3.44 114.38 102.01 2o5j h ARG 1062Ca 0.00 0.06 -0.49 0.00 -1.11 0.00 0.00 59.98 58.43 2o5j h ARG 1062Cb 0.59 0.19 0.00 0.00 -0.01 0.00 0.00 29.97 30.73 2o5j h ARG 1062CO 0.00 -0.53 -0.19 -2.00 -3.11 0.00 0.00 179.97 174.14 2o5j s GLU 1063N -5.93 3.53 -0.32 0.20 2.56 -1.25 -4.99 118.70 112.50 2o5j s GLU 1063Ca -0.17 -0.23 -0.34 0.00 0.00 0.00 0.00 54.97 54.23 2o5j s GLU 1063Cb 0.03 -2.67 -0.10 0.00 2.00 0.00 0.00 34.13 33.39 2o5j s GLU 1063CO 0.61 0.19 2.20 0.41 -0.56 0.00 0.00 175.26 178.10 2o5j n GLY 1064N -1.44 0.59 3.66 -1.50 0.00 -1.26 -4.44 105.19 100.80 2o5j n GLY 1064Ca -0.04 0.90 -0.42 0.00 0.00 0.00 0.00 46.02 46.46 2o5j n GLY 1064CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2o5j s LEU 1065N 7.54 4.38 1.16 0.99 2.96 -1.26 -4.90 118.68 129.55 2o5j s LEU 1065Ca 1.08 2.46 -0.16 0.00 -0.22 0.00 0.00 54.13 57.29 2o5j s LEU 1065Cb -0.75 -3.53 0.27 0.00 0.50 0.00 0.00 46.19 42.67 2o5j s LEU 1065CO 0.46 -0.99 1.06 0.28 -1.32 0.00 0.00 176.35 175.84 2o5j s THR 1066N 4.26 1.78 0.10 3.68 -1.32 -1.26 -4.75 115.64 118.13 2o5j s THR 1066Ca 0.81 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 61.01 2o5j s THR 1066Cb -0.38 -2.33 -0.11 0.00 -1.51 0.00 0.00 72.50 68.17 2o5j s THR 1066CO 0.36 0.00 1.46 0.58 -2.21 0.00 0.00 174.62 174.81 2o5j h VAL 1067N -2.49 0.00 0.00 5.08 2.07 -2.00 -1.80 116.25 117.10 2o5j h VAL 1067Ca -0.52 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 66.80 2o5j h VAL 1067Cb 1.33 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 2o5j h VAL 1067CO 0.46 0.00 -0.91 -0.07 0.02 0.00 0.00 177.57 177.07 2o5j h LEU 1068N -0.50 0.00 -1.76 2.57 3.38 -2.00 -3.03 115.31 113.98 2o5j h LEU 1068Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2o5j h LEU 1068Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2o5j h LEU 1068CO -0.36 0.91 0.00 -0.33 0.09 0.00 0.00 178.44 178.75 2o5j h GLU 1069N 0.00 0.00 0.01 1.13 5.08 -1.87 -1.73 114.58 117.20 2o5j h GLU 1069Ca -0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2o5j h GLU 1069Cb 1.62 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.87 2o5j h GLU 1069CO 0.12 0.00 -0.17 -0.92 -1.00 0.00 0.00 179.01 177.04 2o5j h TYR 1070N 0.00 0.05 -0.23 4.33 -0.00 -1.21 -3.00 116.97 116.91 2o5j h TYR 1070Ca 0.00 -0.04 0.01 0.00 -0.00 0.00 0.00 58.73 58.71 2o5j h TYR 1070Cb 0.25 -0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.96 2o5j h TYR 1070CO 0.00 1.06 0.16 0.35 -0.00 0.00 0.00 178.16 179.73 2o5j h PHE 1071N -0.94 0.24 0.09 -3.82 3.04 -1.40 -0.02 116.94 114.13 2o5j h PHE 1071Ca -0.04 0.01 -0.28 0.00 3.98 0.00 0.00 57.97 61.64 2o5j h PHE 1071Cb 1.08 -0.08 0.02 0.00 2.56 0.00 0.00 35.95 39.53 2o5j h PHE 1071CO 0.26 0.15 -1.17 0.82 -2.02 0.00 0.00 178.31 176.35 2o5j h ILE 1072N 0.26 1.34 -0.38 1.41 1.08 -1.45 -3.20 117.51 116.57 2o5j h ILE 1072Ca 0.09 -2.52 -0.06 0.00 -0.39 0.00 0.00 64.86 61.98 2o5j h ILE 1072Cb 0.05 2.64 -0.02 0.00 -3.07 0.00 0.00 36.82 36.42 2o5j h ILE 1072CO -0.02 0.76 -0.01 0.28 -0.69 0.00 0.00 178.15 178.47 2o5j h SER 1073N 0.25 0.58 -0.83 1.72 0.02 -1.22 -3.05 113.55 111.02 2o5j h SER 1073Ca -0.15 -0.12 0.18 0.00 -0.84 0.00 0.00 61.79 60.85 2o5j h SER 1073Cb 1.83 -0.15 -0.06 0.00 0.14 0.00 0.00 62.40 64.16 2o5j h SER 1073CO 0.22 0.65 0.55 -1.28 -1.14 0.00 0.00 176.83 175.83 2o5j h SER 1074N 0.58 0.40 -0.78 3.07 0.87 -1.02 -1.10 113.55 115.57 2o5j h SER 1074Ca 0.12 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.66 2o5j h SER 1074Cb 0.38 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.27 2o5j h SER 1074CO 0.01 0.18 0.30 0.45 -0.53 0.00 0.00 176.83 177.25 2o5j h HIS 1075N 0.41 1.19 0.00 2.24 -0.00 -1.62 -2.58 115.15 114.80 2o5j h HIS 1075Ca 0.42 -0.10 -0.03 0.00 -0.00 0.00 0.00 60.37 60.67 2o5j h HIS 1075Cb 1.01 -0.36 -0.00 0.00 -0.00 0.00 0.00 27.41 28.06 2o5j h HIS 1075CO -0.00 0.91 -0.12 0.78 -0.00 0.00 0.00 177.93 179.50 2o5j h GLY 1076N 1.13 0.00 1.31 2.45 0.00 -1.35 -2.41 103.07 104.20 2o5j h GLY 1076Ca 0.26 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.26 2o5j h GLY 1076CO -0.02 0.00 -1.46 0.00 0.00 0.00 0.00 176.54 175.07 2o5j h ALA 1077N 1.88 -0.13 -0.44 3.60 0.00 -1.41 -3.09 119.26 119.66 2o5j h ALA 1077Ca -0.00 -0.86 -0.03 0.00 0.00 0.00 0.00 54.91 54.01 2o5j h ALA 1077Cb 0.33 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2o5j h ALA 1077CO 0.02 0.73 0.16 0.00 0.00 0.00 0.00 179.25 180.15 2o5j h ARG 1078N 0.14 0.67 -0.31 0.00 2.47 -1.14 -2.53 114.38 113.68 2o5j h ARG 1078Ca -0.24 -0.13 -0.06 0.00 -1.26 0.00 0.00 59.98 58.28 2o5j h ARG 1078Cb 2.15 -0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 30.35 2o5j h ARG 1078CO 0.27 0.64 -0.06 0.87 0.56 0.00 0.00 179.97 182.25 2o5j h LYS 1079N 0.57 0.50 0.52 0.04 1.57 -1.56 -3.32 116.57 114.89 2o5j h LYS 1079Ca 0.14 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 2o5j h LYS 1079Cb 0.23 -0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.48 2o5j h LYS 1079CO -0.01 0.57 -0.25 0.78 -0.57 0.00 0.00 179.45 179.97 2o5j h GLY 1080N 0.87 -0.73 -1.19 3.86 0.00 -1.41 -3.10 103.07 101.36 2o5j h GLY 1080Ca 0.10 0.27 0.44 0.00 0.00 0.00 0.00 47.33 48.14 2o5j h GLY 1080CO 0.02 -0.27 0.72 0.61 0.00 0.00 0.00 176.54 177.63 2o5j n GLY 1081N -0.15 -0.78 0.26 4.60 0.00 -0.98 0.18 105.19 108.32 2o5j n GLY 1081Ca -0.09 0.76 -0.12 0.00 0.00 0.00 0.00 46.02 46.57 2o5j n GLY 1081CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o5j h ALA 1082N 1.72 0.60 -0.21 4.61 0.00 -1.65 -3.25 119.26 121.07 2o5j h ALA 1082Ca 0.85 -0.40 0.05 0.00 0.00 0.00 0.00 54.91 55.40 2o5j h ALA 1082Cb 2.53 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 20.11 2o5j h ALA 1082CO -0.58 0.61 -0.40 0.22 0.00 0.00 0.00 179.25 179.10 2o5j h ASP 1083N 0.74 -1.29 -0.64 0.00 3.58 0.20 -1.80 116.42 117.21 2o5j h ASP 1083Ca 0.09 0.18 0.06 0.00 0.42 0.00 0.00 57.03 57.78 2o5j h ASP 1083Cb 0.84 0.54 -0.04 0.00 1.72 0.00 0.00 39.33 42.39 2o5j h ASP 1083CO 0.07 -0.40 0.43 0.00 -2.88 0.00 0.00 179.24 176.46 2o5j h THR 1084N -0.43 1.00 0.28 2.25 1.03 -1.54 -1.17 112.91 114.34 2o5j h THR 1084Ca 0.10 -0.22 -0.01 0.00 -0.01 0.00 0.00 66.41 66.27 2o5j h THR 1084Cb 0.60 0.31 -0.00 0.00 -1.07 0.00 0.00 68.15 67.99 2o5j h THR 1084CO -0.44 0.12 -0.17 0.00 -0.01 0.00 0.00 175.52 175.02 2o5j h ALA 1085N 1.65 -0.42 -0.48 0.00 0.00 -1.38 0.70 119.26 119.33 2o5j h ALA 1085Ca 0.28 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2o5j h ALA 1085Cb 0.29 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2o5j h ALA 1085CO -0.09 -0.74 0.05 -0.07 0.00 0.00 0.00 179.25 178.40 2o5j h LEU 1086N -0.43 0.72 -0.75 0.00 4.07 -1.32 -2.44 115.31 115.16 2o5j h LEU 1086Ca -0.03 -0.15 -0.13 0.00 0.08 0.00 0.00 57.88 57.65 2o5j h LEU 1086Cb 0.35 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 41.89 2o5j h LEU 1086CO 0.04 0.76 -0.53 0.03 -1.08 0.00 0.00 178.44 177.65 2o5j h ARG 1087N 0.73 0.25 -0.14 1.13 2.47 -0.75 -2.22 114.38 115.84 2o5j h ARG 1087Ca 0.15 -0.15 -0.13 0.00 -1.26 0.00 0.00 59.98 58.59 2o5j h ARG 1087Cb 0.37 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.70 2o5j h ARG 1087CO 0.01 0.72 -0.47 1.15 0.56 0.00 0.00 179.97 181.94 2o5j h THR 1088N 0.19 1.33 0.00 2.04 2.02 0.62 -2.06 112.91 117.05 2o5j h THR 1088Ca 0.00 -1.68 -0.10 0.00 0.77 0.00 0.00 66.41 65.41 2o5j h THR 1088Cb 1.01 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 69.14 2o5j h THR 1088CO 0.08 0.51 -0.49 0.00 0.37 0.00 0.00 175.52 176.00 2o5j h ALA 1089N 1.22 1.11 -0.00 6.16 0.00 -1.05 -2.77 119.26 123.93 2o5j h ALA 1089Ca 0.02 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2o5j h ALA 1089Cb 0.94 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2o5j h ALA 1089CO 0.08 0.61 -0.55 -0.25 0.00 0.00 0.00 179.25 179.13 2o5j n ASP 1090N -3.84 0.55 0.05 0.00 9.92 -0.87 -1.76 116.55 120.61 2o5j n ASP 1090Ca -0.01 -0.33 -0.16 0.00 -0.53 0.00 0.00 54.79 53.75 2o5j n ASP 1090Cb 0.52 0.33 -0.07 0.00 -0.64 0.00 0.00 41.12 41.27 2o5j n ASP 1090CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 2o5j h SER 1091N 0.00 0.73 0.64 -2.24 0.02 -1.10 0.10 113.55 111.71 2o5j h SER 1091Ca 0.00 -0.57 -0.13 0.00 -0.84 0.00 0.00 61.79 60.25 2o5j h SER 1091Cb 0.50 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 2o5j h SER 1091CO 0.00 1.36 -0.63 1.23 -1.14 0.00 0.00 176.83 177.66 2o5j h GLY 1092N 0.82 0.00 0.71 -3.77 0.00 -1.53 -1.32 103.07 97.99 2o5j h GLY 1092Ca -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2o5j h GLY 1092CO 0.18 0.00 -0.06 -1.82 0.00 0.00 0.00 176.54 174.84 2o5j h TYR 1093N 0.00 -0.14 -0.57 5.60 5.03 -1.21 0.13 116.97 125.81 2o5j h TYR 1093Ca -0.01 -0.00 0.09 0.00 2.58 0.00 0.00 58.73 61.39 2o5j h TYR 1093Cb 1.12 0.05 -0.07 0.00 1.55 0.00 0.00 36.73 39.37 2o5j h TYR 1093CO 0.00 0.15 0.20 1.25 -1.32 0.00 0.00 178.16 178.44 2o5j h LEU 1094N -0.44 0.18 -0.08 2.82 5.85 -0.68 -0.90 115.31 122.05 2o5j h LEU 1094Ca -0.02 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 2o5j h LEU 1094Cb 0.36 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 2o5j h LEU 1094CO 0.03 0.11 0.01 0.74 -0.34 0.00 0.00 178.44 178.99 2o5j h THR 1095N 0.37 1.22 -0.51 1.05 2.02 -1.05 0.35 112.91 116.35 2o5j h THR 1095Ca 0.29 -0.69 0.03 0.00 0.77 0.00 0.00 66.41 66.81 2o5j h THR 1095Cb 0.35 1.53 -0.04 0.00 -1.74 0.00 0.00 68.15 68.25 2o5j h THR 1095CO -0.30 0.19 0.29 -0.09 0.37 0.00 0.00 175.52 175.98 2o5j h ARG 1096N -0.12 0.55 0.26 6.66 2.43 -0.50 0.49 114.38 124.16 2o5j h ARG 1096Ca 0.02 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2o5j h ARG 1096Cb 0.29 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 2o5j h ARG 1096CO 0.00 0.36 -0.13 0.87 -1.51 0.00 0.00 179.97 179.57 2o5j h LYS 1097N 0.57 -0.34 -0.37 0.20 1.79 -1.08 0.89 116.57 118.23 2o5j h LYS 1097Ca 0.22 0.02 0.05 0.00 -2.18 0.00 0.00 60.65 58.76 2o5j h LYS 1097Cb 0.07 0.08 -0.05 0.00 -1.58 0.00 0.00 32.23 30.75 2o5j h LYS 1097CO -0.12 -0.17 0.07 -0.07 -1.08 0.00 0.00 179.45 178.08 2o5j h LEU 1098N -0.43 0.01 -0.41 2.94 4.07 -0.60 -2.27 115.31 118.63 2o5j h LEU 1098Ca -0.04 0.06 -0.05 0.00 0.08 0.00 0.00 57.88 57.93 2o5j h LEU 1098Cb 0.32 0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.13 2o5j h LEU 1098CO 0.06 0.04 0.04 0.58 -1.08 0.00 0.00 178.44 178.08 2o5j h VAL 1099N 0.19 1.25 -0.34 1.22 2.07 0.25 -0.24 116.25 120.66 2o5j h VAL 1099Ca 0.17 -0.93 0.04 0.00 0.82 0.00 0.00 66.70 66.81 2o5j h VAL 1099Cb 0.20 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2o5j h VAL 1099CO -0.23 0.32 0.23 0.44 0.02 0.00 0.00 177.57 178.35 2o5j h ASP 1100N 0.54 0.26 0.40 0.57 5.19 0.13 0.97 116.42 124.47 2o5j h ASP 1100Ca 0.12 -0.00 -0.31 0.00 -0.62 0.00 0.00 57.03 56.22 2o5j h ASP 1100Cb 0.41 -0.06 -0.05 0.00 0.18 0.00 0.00 39.33 39.81 2o5j h ASP 1100CO 0.01 0.18 -1.83 0.52 -3.12 0.00 0.00 179.24 175.00 2o5j n VAL 1101N -4.48 1.58 -0.26 -1.35 0.31 -0.90 -4.35 118.33 108.88 2o5j n VAL 1101Ca 0.04 -0.80 0.10 0.00 -0.01 0.00 0.00 64.34 63.66 2o5j n VAL 1101Cb 0.20 -0.97 0.26 0.00 -0.91 0.00 0.00 33.84 32.41 2o5j n VAL 1101CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2o5j n THR 1102N -3.01 0.97 0.09 2.52 -1.04 -0.11 -4.56 114.28 109.13 2o5j n THR 1102Ca -0.20 -0.98 -0.12 0.00 -2.04 0.00 0.00 64.05 60.71 2o5j n THR 1102Cb 1.07 0.53 -0.09 0.00 -1.82 0.00 0.00 70.33 70.02 2o5j n THR 1102CO 0.00 0.00 0.00 1.12 -0.64 0.00 0.00 175.07 175.55 2o5j h HIS 1103N 3.48 0.35 0.00 -1.42 -0.00 -1.01 -3.22 115.15 113.34 2o5j h HIS 1103Ca 0.00 -0.23 -0.03 0.00 -0.00 0.00 0.00 60.37 60.11 2o5j h HIS 1103Cb 0.89 -0.02 -0.00 0.00 -0.00 0.00 0.00 27.41 28.27 2o5j h HIS 1103CO 0.38 1.13 -0.15 1.05 -0.00 0.00 0.00 177.93 180.34 2o5j h GLU 1104N 0.09 0.00 -6.08 5.12 4.11 -1.85 -3.41 114.58 112.56 2o5j h GLU 1104Ca -0.08 0.00 -0.58 0.00 0.07 0.00 0.00 59.36 58.77 2o5j h GLU 1104Cb 1.76 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.00 2o5j h GLU 1104CO 0.17 0.15 1.42 0.42 0.07 0.00 0.00 179.01 181.23 2o5j s ILE 1105N -4.07 3.15 0.02 -1.06 -1.09 -1.22 -4.66 121.20 112.28 2o5j s ILE 1105Ca -0.02 0.15 0.00 0.00 -2.23 0.00 0.00 60.65 58.55 2o5j s ILE 1105Cb 0.12 -3.20 -0.02 0.00 -1.58 0.00 0.00 42.46 37.79 2o5j s ILE 1105CO 0.60 -0.12 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.46 2o5j s VAL 1106N 7.75 0.17 -0.48 2.92 1.01 -1.26 -4.05 120.40 126.46 2o5j s VAL 1106Ca 0.94 -0.99 -0.29 0.00 0.00 0.00 0.00 61.98 61.65 2o5j s VAL 1106Cb -0.30 -0.38 0.02 0.00 0.00 0.00 0.00 36.38 35.72 2o5j s VAL 1106CO 0.35 -0.52 1.31 -0.69 0.00 0.00 0.00 175.10 175.55 2o5j s VAL 1107N -1.60 3.98 -0.27 2.92 1.01 -1.15 -1.87 120.40 123.42 2o5j s VAL 1107Ca -0.14 0.96 -0.03 0.00 0.00 0.00 0.00 61.98 62.78 2o5j s VAL 1107Cb -0.09 -4.42 0.11 0.00 0.00 0.00 0.00 36.38 31.98 2o5j s VAL 1107CO -0.01 -0.97 0.21 0.00 0.00 0.00 0.00 175.10 174.32 2o5j s ARG 1108N 4.91 0.24 0.06 2.72 1.70 -1.23 0.11 118.95 127.46 2o5j s ARG 1108Ca 0.54 -0.25 -0.04 0.00 -0.47 0.00 0.00 55.73 55.51 2o5j s ARG 1108Cb -0.10 -1.01 0.01 0.00 -0.57 0.00 0.00 34.95 33.29 2o5j s ARG 1108CO 0.30 -0.95 0.20 -0.85 -1.08 0.00 0.00 175.30 172.92 2o5j n GLU 1109N 5.29 0.19 -3.90 3.89 -0.00 -1.26 -4.79 120.64 120.05 2o5j n GLU 1109Ca -0.04 -0.40 -0.11 0.00 -0.00 0.00 0.00 57.16 56.61 2o5j n GLU 1109Cb 0.45 0.52 -0.12 0.00 -0.00 0.00 0.00 31.44 32.30 2o5j n GLU 1109CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2o5j s ALA 1110N -1.23 -0.11 -0.53 -1.84 0.00 -1.26 -4.98 121.76 111.81 2o5j s ALA 1110Ca 0.04 -0.18 -0.36 0.00 0.00 0.00 0.00 51.96 51.46 2o5j s ALA 1110Cb -0.01 0.04 -0.15 0.00 0.00 0.00 0.00 23.12 23.00 2o5j s ALA 1110CO 0.02 -0.13 2.29 -3.47 0.00 0.00 0.00 175.76 174.47 2o5j n ASP 1111N 2.08 1.38 -4.64 0.00 2.03 -1.26 -4.74 116.55 111.40 2o5j n ASP 1111Ca -0.19 0.37 -0.45 0.00 0.52 0.00 0.00 54.79 55.04 2o5j n ASP 1111Cb 0.57 -1.11 -0.04 0.00 -0.72 0.00 0.00 41.12 39.81 2o5j n ASP 1111CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2o5j h GLY 1113N 11.13 0.00 -6.86 0.00 0.00 -2.03 -3.42 103.07 101.89 2o5j h GLY 1113Ca -0.46 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.30 2o5j h GLY 1113CO 0.95 0.00 1.23 -1.08 0.00 0.00 0.00 176.54 177.64 2o5j s THR 1114N -3.54 3.58 -0.81 4.70 -1.32 -1.26 -4.88 115.64 112.11 2o5j s THR 1114Ca 0.00 0.59 -0.10 0.00 -1.21 0.00 0.00 61.69 60.97 2o5j s THR 1114Cb 0.09 -3.78 0.21 0.00 -1.51 0.00 0.00 72.50 67.50 2o5j s THR 1114CO 0.34 -0.50 0.72 -0.89 -2.21 0.00 0.00 174.62 172.08 2o5j s THR 1115N 6.53 5.08 0.02 5.08 2.01 -1.26 -4.82 115.64 128.28 2o5j s THR 1115Ca 0.75 -2.79 0.03 0.00 0.31 0.00 0.00 61.69 59.99 2o5j s THR 1115Cb -0.20 -4.16 -0.01 0.00 0.01 0.00 0.00 72.50 68.13 2o5j s THR 1115CO 0.33 -1.01 -0.09 0.20 -0.69 0.00 0.00 174.62 173.36 2o5j s ASN 1116N 1.54 1.09 0.30 3.53 0.01 -1.26 -5.12 114.94 115.02 2o5j s ASN 1116Ca 0.20 -0.31 -0.06 0.00 -0.71 0.00 0.00 52.86 51.98 2o5j s ASN 1116Cb -0.13 -0.07 0.02 0.00 0.41 0.00 0.00 41.25 41.49 2o5j s ASN 1116CO -0.08 0.01 0.50 0.00 -1.51 0.00 0.00 177.10 176.03 2o5j n TYR 1117N 2.33 -1.60 -4.43 2.20 0.18 -1.26 -4.72 117.16 109.85 2o5j n TYR 1117Ca -0.16 -1.78 -0.33 0.00 1.88 0.00 0.00 57.90 57.50 2o5j n TYR 1117Cb 0.56 0.57 -0.10 0.00 -0.38 0.00 0.00 39.34 39.99 2o5j n TYR 1117CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 2o5j s ILE 1118N -2.57 3.98 -0.29 -3.48 -1.09 -0.95 -4.93 121.20 111.87 2o5j s ILE 1118Ca 0.20 -0.52 -0.07 0.00 -2.23 0.00 0.00 60.65 58.03 2o5j s ILE 1118Cb -0.02 -2.71 0.00 0.00 -1.58 0.00 0.00 42.46 38.16 2o5j s ILE 1118CO 0.14 0.49 0.07 -0.44 -1.23 0.00 0.00 174.94 173.98 2o5j s SER 1119N -1.18 5.07 -0.31 3.58 0.01 -1.25 -1.23 113.70 118.38 2o5j s SER 1119Ca 0.16 -0.64 -0.28 0.00 1.31 0.00 0.00 55.95 56.50 2o5j s SER 1119Cb -0.11 -1.87 0.01 0.00 0.21 0.00 0.00 66.02 64.26 2o5j s SER 1119CO 0.06 -0.17 1.01 -0.69 0.41 0.00 0.00 173.24 173.86 2o5j s VAL 1120N 1.51 4.58 0.26 3.43 1.01 -0.21 -4.60 120.40 126.37 2o5j s VAL 1120Ca 0.03 1.62 -0.29 0.00 0.00 0.00 0.00 61.98 63.33 2o5j s VAL 1120Cb -0.17 -4.35 -0.09 0.00 0.00 0.00 0.00 36.38 31.77 2o5j s VAL 1120CO 0.02 -0.42 1.23 -2.84 0.00 0.00 0.00 175.10 173.09 2o5j s PRO 1121N 3.48 4.47 -0.00 2.72 0.02 -1.26 -1.14 135.00 143.28 2o5j s PRO 1121Ca 0.42 2.01 0.16 0.00 0.02 0.00 0.00 61.00 63.61 2o5j s PRO 1121Cb -0.13 -3.16 -0.19 0.00 0.02 0.00 0.00 34.50 31.04 2o5j s PRO 1121CO 0.14 -0.07 0.62 1.28 -0.33 0.00 0.00 177.00 178.64 2o5j n LEU 1122N 1.58 0.60 -4.35 -5.54 4.32 -1.14 -4.98 117.00 107.49 2o5j n LEU 1122Ca 0.02 -0.39 -0.26 0.00 -0.02 0.00 0.00 56.01 55.35 2o5j n LEU 1122Cb 0.43 0.00 -0.13 0.00 -1.62 0.00 0.00 43.42 42.11 2o5j n LEU 1122CO 0.57 0.15 -0.54 -0.36 -1.22 0.00 0.00 177.39 175.99 2o5j s PHE 1123N -2.67 2.08 -0.08 -1.77 0.08 -1.26 -0.21 117.98 114.14 2o5j s PHE 1123Ca 0.03 -0.40 0.04 0.00 0.12 0.00 0.00 56.93 56.73 2o5j s PHE 1123Cb 0.12 -1.11 0.00 0.00 -0.57 0.00 0.00 43.02 41.46 2o5j s PHE 1123CO 0.67 0.31 -0.22 1.14 -0.10 0.00 0.00 175.22 177.02 2o5j s GLN 1124N -2.14 2.66 0.00 0.44 -2.07 -0.80 -4.84 119.66 112.91 2o5j s GLN 1124Ca 0.12 -0.79 0.00 0.00 -1.82 0.00 0.00 55.36 52.87 2o5j s GLN 1124Cb -0.09 -2.08 0.00 0.00 -1.09 0.00 0.00 33.01 29.75 2o5j s GLN 1124CO 0.06 0.19 0.50 -2.30 -1.32 0.00 0.00 175.29 172.42 2o5j n PRO 1125N 3.45 0.00 -3.87 9.60 -0.02 -1.26 -3.31 135.00 139.60 2o5j n PRO 1125Ca -0.19 0.18 -0.33 0.00 -2.02 0.00 0.00 63.50 61.13 2o5j n PRO 1125Cb 0.53 -1.00 -0.13 0.00 -0.02 0.00 0.00 33.50 32.88 2o5j n PRO 1125CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2o5j s ASP 1126N -2.36 4.92 -0.24 2.55 -1.08 -1.26 -3.51 116.67 115.69 2o5j s ASP 1126Ca 0.00 -2.44 -0.10 0.00 -0.52 0.00 0.00 52.55 49.49 2o5j s ASP 1126Cb 0.00 -1.74 -0.11 0.00 -1.46 0.00 0.00 42.92 39.61 2o5j s ASP 1126CO 0.00 -0.40 -0.29 1.21 0.52 0.00 0.00 175.17 176.21 2o5j n GLU 1127N 3.96 0.52 -4.56 4.34 0.00 -1.26 -4.89 120.64 118.74 2o5j n GLU 1127Ca 0.03 0.21 -0.34 0.00 0.00 0.00 0.00 57.16 57.06 2o5j n GLU 1127Cb 0.39 -1.37 -0.12 0.00 0.00 0.00 0.00 31.44 30.34 2o5j n GLU 1127CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2o5j s VAL 1128N -2.44 3.67 0.00 6.31 1.01 -1.26 -5.07 120.40 122.62 2o5j s VAL 1128Ca -0.33 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.19 2o5j s VAL 1128Cb 0.12 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.95 2o5j s VAL 1128CO 0.44 0.54 0.00 0.35 0.00 0.00 0.00 175.10 176.43 2o5j n THR 1129N 2.96 0.00 -3.83 3.92 -2.24 -1.26 -3.66 114.28 110.17 2o5j n THR 1129Ca -0.18 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.31 2o5j n THR 1129Cb 0.53 0.00 -0.16 0.00 -2.10 0.00 0.00 70.33 68.60 2o5j n THR 1129CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2o5j s ARG 1130N 0.00 1.12 -0.26 -0.78 6.06 -1.26 -4.27 118.95 119.56 2o5j s ARG 1130Ca 0.00 -0.72 -0.05 0.00 -2.50 0.00 0.00 55.73 52.46 2o5j s ARG 1130Cb 0.00 -2.34 0.14 0.00 0.06 0.00 0.00 34.95 32.80 2o5j s ARG 1130CO 0.00 -0.63 0.49 -1.54 -2.50 0.00 0.00 175.30 171.12 2o5j s SER 1131N 1.63 -0.55 0.29 -2.12 1.04 -1.23 -5.11 113.70 107.65 2o5j s SER 1131Ca -0.03 0.83 -0.29 0.00 0.48 0.00 0.00 55.95 56.94 2o5j s SER 1131Cb -0.18 1.65 -0.10 0.00 0.10 0.00 0.00 66.02 67.50 2o5j s SER 1131CO -0.08 -0.26 1.23 -0.76 0.98 0.00 0.00 173.24 174.36 2o5j s LEU 1132N 2.71 4.47 0.03 2.42 1.02 -1.26 -4.69 118.68 123.37 2o5j s LEU 1132Ca 0.08 2.48 -0.04 0.00 0.02 0.00 0.00 54.13 56.67 2o5j s LEU 1132Cb -0.14 -3.63 -0.01 0.00 0.02 0.00 0.00 46.19 42.42 2o5j s LEU 1132CO -0.17 -0.39 0.06 0.00 0.02 0.00 0.00 176.35 175.87 2o5j s ARG 1133N -1.35 0.49 -0.05 1.70 1.70 -1.21 -5.01 118.95 115.23 2o5j s ARG 1133Ca 0.49 -0.68 -0.30 0.00 -0.47 0.00 0.00 55.73 54.77 2o5j s ARG 1133Cb -0.36 0.19 -0.03 0.00 -0.57 0.00 0.00 34.95 34.17 2o5j s ARG 1133CO 0.46 -0.11 1.22 -1.17 -1.08 0.00 0.00 175.30 174.61 2o5j s LEU 1134N -1.84 4.28 0.84 -1.89 0.20 -1.26 -1.90 118.68 117.11 2o5j s LEU 1134Ca -0.09 1.84 -0.14 0.00 0.69 0.00 0.00 54.13 56.43 2o5j s LEU 1134Cb -0.04 -3.56 0.04 0.00 -0.43 0.00 0.00 46.19 42.20 2o5j s LEU 1134CO -0.03 -0.59 0.77 -1.14 -0.29 0.00 0.00 176.35 175.07 2o5j n ARG 1135N 5.19 0.00 -1.81 1.98 0.63 0.71 -4.87 116.66 118.49 2o5j n ARG 1135Ca 0.11 0.06 -0.38 0.00 -0.92 0.00 0.00 57.85 56.73 2o5j n ARG 1135Cb 0.46 -2.09 0.05 0.00 0.45 0.00 0.00 32.46 31.32 2o5j n ARG 1135CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2o5j s LYS 1136N -3.66 2.99 0.09 -0.14 1.02 -1.26 -4.80 119.74 113.98 2o5j s LYS 1136Ca 0.66 2.14 -0.25 0.00 0.02 0.00 0.00 55.97 58.54 2o5j s LYS 1136Cb -0.27 -2.13 -0.09 0.00 -0.52 0.00 0.00 37.83 34.81 2o5j s LYS 1136CO 0.59 -1.28 1.40 -0.09 -0.92 0.00 0.00 175.35 175.05 2o5j h ARG 1137N 1.19 -0.39 -0.47 1.68 2.43 -2.00 -1.69 114.38 115.14 2o5j h ARG 1137Ca -0.51 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 58.74 2o5j h ARG 1137Cb 1.31 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.86 2o5j h ARG 1137CO 0.56 -0.26 -0.53 0.00 -1.51 0.00 0.00 179.97 178.23 2o5j h ALA 1138N -0.57 -0.72 -0.46 2.80 0.00 -1.99 -1.19 119.26 117.13 2o5j h ALA 1138Ca 0.03 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2o5j h ALA 1138Cb 0.49 1.14 -0.05 0.00 0.00 0.00 0.00 17.79 19.37 2o5j h ALA 1138CO -0.34 -0.99 0.19 0.38 0.00 0.00 0.00 179.25 178.49 2o5j h ASP 1139N -0.31 0.23 -0.68 0.00 2.03 -1.90 -0.37 116.42 115.42 2o5j h ASP 1139Ca 0.08 0.04 0.02 0.00 -0.73 0.00 0.00 57.03 56.44 2o5j h ASP 1139Cb 0.53 0.01 -0.04 0.00 -0.83 0.00 0.00 39.33 39.00 2o5j h ASP 1139CO -0.61 0.17 0.43 0.40 -1.03 0.00 0.00 179.24 178.60 2o5j h ILE 1140N 0.38 1.12 -0.49 4.15 2.04 -0.89 -1.14 117.51 122.68 2o5j h ILE 1140Ca 0.21 -0.30 0.07 0.00 1.00 0.00 0.00 64.86 65.84 2o5j h ILE 1140Cb 0.17 0.18 -0.06 0.00 -0.74 0.00 0.00 36.82 36.38 2o5j h ILE 1140CO -0.19 0.16 0.17 -0.33 0.00 0.00 0.00 178.15 177.96 2o5j h GLU 1141N 0.86 0.34 -0.84 2.37 4.39 -0.63 -1.44 114.58 119.64 2o5j h GLU 1141Ca 0.26 -0.02 0.11 0.00 0.34 0.00 0.00 59.36 60.05 2o5j h GLU 1141Cb -0.03 -0.08 -0.08 0.00 -0.10 0.00 0.00 28.75 28.47 2o5j h GLU 1141CO -0.09 0.22 0.47 0.00 -1.16 0.00 0.00 179.01 178.46 2o5j h ALA 1142N 1.32 1.21 -0.05 3.43 0.00 -0.14 0.42 119.26 125.45 2o5j h ALA 1142Ca 0.23 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2o5j h ALA 1142Cb 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2o5j h ALA 1142CO -0.24 0.06 -0.02 0.78 0.00 0.00 0.00 179.25 179.83 2o5j h GLY 1143N 0.77 0.12 -0.62 0.00 0.00 -0.20 -3.32 103.07 99.81 2o5j h GLY 1143Ca 0.42 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.64 2o5j h GLY 1143CO -0.27 0.10 -0.41 1.04 0.00 0.00 0.00 176.54 177.00 2o5j n LEU 1144N -4.80 1.49 -4.66 3.11 4.77 -0.83 -4.86 117.00 111.20 2o5j n LEU 1144Ca -0.07 -0.72 -0.43 0.00 -0.03 0.00 0.00 56.01 54.76 2o5j n LEU 1144Cb 0.24 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 2o5j n LEU 1144CO 0.35 0.29 0.79 0.00 -1.33 0.00 0.00 177.39 177.49 2o5j n TYR 1145N -0.33 1.94 -4.20 -1.77 4.19 0.15 -2.16 117.16 114.98 2o5j n TYR 1145Ca 0.06 0.60 -0.37 0.00 3.31 0.00 0.00 57.90 61.50 2o5j n TYR 1145Cb 0.33 -2.36 -0.07 0.00 0.49 0.00 0.00 39.34 37.72 2o5j n TYR 1145CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2o5j n GLY 1146N 0.92 -0.31 3.11 2.98 0.00 -0.21 -4.92 105.19 106.75 2o5j n GLY 1146Ca 0.06 0.08 -0.16 0.00 0.00 0.00 0.00 46.02 46.00 2o5j n GLY 1146CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j n ARG 1147N -3.76 0.53 -4.02 1.61 1.74 -0.92 -2.40 116.66 109.45 2o5j n ARG 1147Ca 0.04 -2.41 -0.31 0.00 -0.77 0.00 0.00 57.85 54.40 2o5j n ARG 1147Cb 0.44 -0.27 -0.16 0.00 -1.02 0.00 0.00 32.46 31.45 2o5j n ARG 1147CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2o5j s VAL 1148N -1.99 1.68 0.05 1.55 1.01 -1.26 -1.80 120.40 119.63 2o5j s VAL 1148Ca 0.49 -0.90 -0.35 0.00 0.00 0.00 0.00 61.98 61.22 2o5j s VAL 1148Cb -0.04 -1.67 -0.15 0.00 0.00 0.00 0.00 36.38 34.52 2o5j s VAL 1148CO 0.32 0.29 1.57 0.18 0.00 0.00 0.00 175.10 177.46 2o5j n LEU 1149N 4.70 2.63 0.09 3.92 4.77 -1.13 0.90 117.00 132.87 2o5j n LEU 1149Ca -0.16 1.07 -0.08 0.00 -0.03 0.00 0.00 56.01 56.82 2o5j n LEU 1149Cb 0.48 -1.31 -0.04 0.00 -2.33 0.00 0.00 43.42 40.22 2o5j n LEU 1149CO 0.21 -0.50 0.21 0.00 -1.33 0.00 0.00 177.39 175.99 2o5j h ALA 1150N 6.19 0.48 -2.25 -1.18 0.00 -0.98 -0.27 119.26 121.26 2o5j h ALA 1150Ca -0.47 -0.79 -0.13 0.00 0.00 0.00 0.00 54.91 53.52 2o5j h ALA 1150Cb 1.29 -0.10 -0.15 0.00 0.00 0.00 0.00 17.79 18.83 2o5j h ALA 1150CO 0.87 1.03 -0.68 -0.98 0.00 0.00 0.00 179.25 179.49 2o5j s ARG 1151N -3.02 0.65 0.20 0.00 1.70 -1.25 -4.71 118.95 112.51 2o5j s ARG 1151Ca -0.01 -1.24 -0.30 0.00 -0.47 0.00 0.00 55.73 53.71 2o5j s ARG 1151Cb 0.10 0.16 -0.08 0.00 -0.57 0.00 0.00 34.95 34.56 2o5j s ARG 1151CO 0.82 -0.10 1.20 -2.00 -1.08 0.00 0.00 175.30 174.13 2o5j s GLU 1152N -3.91 4.50 -0.10 3.89 2.12 -1.26 -4.61 118.70 119.32 2o5j s GLU 1152Ca 0.08 1.89 0.00 0.00 0.36 0.00 0.00 54.97 57.30 2o5j s GLU 1152Cb 0.08 -3.23 0.02 0.00 0.26 0.00 0.00 34.13 31.26 2o5j s GLU 1152CO -0.09 -0.07 -0.08 0.08 -0.54 0.00 0.00 175.26 174.56 2o5j s VAL 1153N -0.21 1.01 -0.35 3.70 1.01 -0.61 -4.96 120.40 120.00 2o5j s VAL 1153Ca 0.52 -0.30 -0.16 0.00 0.00 0.00 0.00 61.98 62.03 2o5j s VAL 1153Cb -0.33 -1.02 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 2o5j s VAL 1153CO 0.38 0.36 0.40 -0.70 0.00 0.00 0.00 175.10 175.54 2o5j s GLU 1154N 1.52 3.54 0.00 2.72 2.12 -1.26 -1.77 118.70 125.56 2o5j s GLU 1154Ca 0.01 -0.39 0.00 0.00 0.36 0.00 0.00 54.97 54.96 2o5j s GLU 1154Cb -0.13 -3.82 0.00 0.00 0.26 0.00 0.00 34.13 30.44 2o5j s GLU 1154CO -0.06 -0.58 0.00 0.28 -0.54 0.00 0.00 175.26 174.36 2o5j n VAL 1155N 5.30 0.00 0.64 3.70 0.31 -1.14 -4.93 118.33 122.21 2o5j n VAL 1155Ca -0.08 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.38 2o5j n VAL 1155Cb 0.49 -0.10 0.30 0.00 -0.91 0.00 0.00 33.84 33.62 2o5j n VAL 1155CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2o5j n LEU 1156N 0.00 0.70 0.00 7.52 4.77 -1.26 -4.80 117.00 123.93 2o5j n LEU 1156Ca 0.00 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 2o5j n LEU 1156Cb 0.00 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 2o5j n LEU 1156CO 0.00 -0.10 0.00 0.61 -1.33 0.00 0.00 177.39 176.57 2o5j n GLY 1157N 1.34 0.20 3.90 -0.72 0.00 -1.26 -5.13 105.19 103.52 2o5j n GLY 1157Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2o5j n GLY 1157CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 1158N 0.00 5.10 -0.61 1.61 1.01 -1.26 -5.07 120.40 121.18 2o5j s VAL 1158Ca 0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 61.98 61.86 2o5j s VAL 1158Cb 0.00 -3.69 0.16 0.00 0.00 0.00 0.00 36.38 32.85 2o5j s VAL 1158CO 0.00 -0.15 0.52 -0.60 0.00 0.00 0.00 175.10 174.87 2o5j s ARG 1159N -3.15 2.94 -0.40 2.72 3.52 -1.26 -2.88 118.95 120.44 2o5j s ARG 1159Ca 0.42 -2.05 -0.28 0.00 -0.13 0.00 0.00 55.73 53.69 2o5j s ARG 1159Cb -0.11 -4.14 -0.00 0.00 -1.56 0.00 0.00 34.95 29.14 2o5j s ARG 1159CO 0.27 -1.25 1.57 -0.51 -0.81 0.00 0.00 175.30 174.57 2o5j s LEU 1160N 0.90 3.53 0.86 -0.88 1.43 -0.73 -4.98 118.68 118.81 2o5j s LEU 1160Ca 0.10 0.96 -0.12 0.00 -1.03 0.00 0.00 54.13 54.04 2o5j s LEU 1160Cb -0.22 -3.47 0.11 0.00 0.03 0.00 0.00 46.19 42.63 2o5j s LEU 1160CO -0.02 -1.58 1.10 -1.83 0.23 0.00 0.00 176.35 174.24 2o5j s GLU 1161N 5.30 1.56 0.74 1.70 1.03 -1.26 -1.57 118.70 126.20 2o5j s GLU 1161Ca 0.68 0.71 -0.12 0.00 0.03 0.00 0.00 54.97 56.26 2o5j s GLU 1161Cb -0.17 -1.85 0.04 0.00 -0.80 0.00 0.00 34.13 31.35 2o5j s GLU 1161CO 0.32 -2.00 1.10 -2.00 -1.33 0.00 0.00 175.26 171.35 2o5j s GLU 1162N -5.05 2.41 0.00 -4.83 -6.30 -1.26 -3.30 118.70 100.37 2o5j s GLU 1162Ca 0.62 1.26 0.00 0.00 -2.50 0.00 0.00 54.97 54.36 2o5j s GLU 1162Cb -0.16 -1.91 0.00 0.00 0.00 0.00 0.00 34.13 32.06 2o5j s GLU 1162CO 0.56 -1.54 0.00 0.41 0.02 0.00 0.00 175.26 174.71 2o5j n GLY 1163N -0.91 0.51 3.73 -1.50 0.00 -0.11 -4.92 105.19 101.99 2o5j n GLY 1163Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2o5j n GLY 1163CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2o5j s ARG 1164N -0.10 4.41 -0.33 1.61 3.00 -1.21 -4.62 118.95 121.71 2o5j s ARG 1164Ca 0.00 2.00 -0.29 0.00 -1.00 0.00 0.00 55.73 56.44 2o5j s ARG 1164Cb 0.00 -3.22 0.02 0.00 0.00 0.00 0.00 34.95 31.75 2o5j s ARG 1164CO 0.00 -0.24 1.11 0.71 0.00 0.00 0.00 175.30 176.89 2o5j s TYR 1165N 0.24 3.05 -0.35 5.12 1.51 -1.26 -2.86 117.35 122.81 2o5j s TYR 1165Ca 0.57 1.10 -0.29 0.00 -1.01 0.00 0.00 57.07 57.44 2o5j s TYR 1165Cb -0.35 -3.80 0.01 0.00 -0.11 0.00 0.00 41.96 37.71 2o5j s TYR 1165CO 0.36 -0.96 1.19 -0.48 -1.11 0.00 0.00 175.55 174.56 2o5j s LEU 1166N 3.83 3.83 0.85 -1.29 2.34 -0.75 -4.90 118.68 122.59 2o5j s LEU 1166Ca 0.47 0.97 -0.11 0.00 0.06 0.00 0.00 54.13 55.52 2o5j s LEU 1166Cb -0.12 -3.54 0.10 0.00 -0.56 0.00 0.00 46.19 42.06 2o5j s LEU 1166CO 0.18 -1.07 1.09 -0.55 -1.06 0.00 0.00 176.35 174.95 2o5j s SER 1167N 2.37 3.93 0.57 1.48 0.15 -1.26 -1.04 113.70 119.90 2o5j s SER 1167Ca 0.51 1.55 0.26 0.00 0.70 0.00 0.00 55.95 58.97 2o5j s SER 1167Cb -0.13 -2.25 1.55 0.00 -1.71 0.00 0.00 66.02 63.49 2o5j s SER 1167CO 0.23 -2.36 2.10 -0.03 1.20 0.00 0.00 173.24 174.38 2o5j h MET 1168N -1.35 0.00 -0.07 5.44 4.05 -1.95 0.40 114.93 121.46 2o5j h MET 1168Ca -0.47 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 58.85 2o5j h MET 1168Cb 1.27 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.05 2o5j h MET 1168CO 0.54 0.00 -0.38 -0.44 0.23 0.00 0.00 176.91 176.86 2o5j h ASP 1169N 0.00 0.14 0.02 1.39 3.32 -1.99 -1.88 116.42 117.42 2o5j h ASP 1169Ca 0.10 -0.05 -0.23 0.00 0.02 0.00 0.00 57.03 56.86 2o5j h ASP 1169Cb 0.48 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 40.00 2o5j h ASP 1169CO -0.00 0.51 -0.89 0.44 -1.72 0.00 0.00 179.24 177.59 2o5j h ASP 1170N 0.12 0.82 0.87 6.45 3.32 -0.56 -2.72 116.42 124.72 2o5j h ASP 1170Ca 0.01 -0.59 0.00 0.00 0.02 0.00 0.00 57.03 56.47 2o5j h ASP 1170Cb 0.73 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.04 2o5j h ASP 1170CO 0.06 1.39 0.00 0.58 -1.72 0.00 0.00 179.24 179.54 2o5j h VAL 1171N 0.42 0.00 0.11 -1.35 2.07 -1.07 -1.55 116.25 114.87 2o5j h VAL 1171Ca -0.08 -0.33 -0.27 0.00 0.82 0.00 0.00 66.70 66.84 2o5j h VAL 1171Cb 1.52 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.44 2o5j h VAL 1171CO 0.17 0.00 -1.21 0.45 0.02 0.00 0.00 177.57 177.01 2o5j h HIS 1172N 0.00 0.47 0.12 1.57 3.86 -1.20 -2.95 115.15 117.03 2o5j h HIS 1172Ca 0.00 -0.34 -0.01 0.00 -1.16 0.00 0.00 60.37 58.87 2o5j h HIS 1172Cb 0.44 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.89 2o5j h HIS 1172CO 0.00 1.25 -0.06 -0.07 0.86 0.00 0.00 177.93 179.92 2o5j h LEU 1173N 0.08 -0.14 -1.42 2.43 4.07 -1.00 -1.91 115.31 117.42 2o5j h LEU 1173Ca -0.12 -0.24 -0.01 0.00 0.08 0.00 0.00 57.88 57.59 2o5j h LEU 1173Cb 1.93 0.04 -0.02 0.00 1.08 0.00 0.00 40.66 43.68 2o5j h LEU 1173CO 0.20 0.17 0.23 -0.07 -1.08 0.00 0.00 178.44 177.88 2o5j h LEU 1174N -0.46 0.55 -0.40 1.67 3.38 -1.44 -0.28 115.31 118.33 2o5j h LEU 1174Ca -0.02 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.76 2o5j h LEU 1174Cb 0.37 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2o5j h LEU 1174CO 0.03 0.46 -0.34 0.40 0.09 0.00 0.00 178.44 179.08 2o5j h ILE 1175N 0.62 1.27 0.00 1.22 2.04 -1.44 -1.47 117.51 119.75 2o5j h ILE 1175Ca 0.16 -1.51 -0.04 0.00 1.00 0.00 0.00 64.86 64.47 2o5j h ILE 1175Cb 0.05 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 2o5j h ILE 1175CO -0.02 0.51 -0.18 0.50 0.00 0.00 0.00 178.15 178.95 2o5j h LYS 1176N 0.77 0.00 -0.02 2.37 3.64 -0.48 -1.08 116.57 121.77 2o5j h LYS 1176Ca 0.07 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.27 2o5j h LYS 1176Cb 0.93 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.77 2o5j h LYS 1176CO 0.09 0.18 -0.71 0.00 -2.27 0.00 0.00 179.45 176.74 2o5j h ALA 1177N 1.82 0.11 -0.07 5.00 0.00 -0.78 -2.72 119.26 122.61 2o5j h ALA 1177Ca -0.00 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.27 2o5j h ALA 1177Cb 0.35 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2o5j h ALA 1177CO 0.02 0.45 -0.13 0.00 0.00 0.00 0.00 179.25 179.59 2o5j h ALA 1178N 0.36 1.65 -0.72 0.00 0.00 -0.98 0.51 119.26 120.08 2o5j h ALA 1178Ca -0.08 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2o5j h ALA 1178Cb 1.40 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.10 2o5j h ALA 1178CO 0.14 0.26 0.46 0.93 0.00 0.00 0.00 179.25 181.04 2o5j h GLU 1179N 0.11 0.95 -0.20 0.00 5.08 -1.15 -1.86 114.58 117.52 2o5j h GLU 1179Ca 0.02 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.18 2o5j h GLU 1179Cb 0.30 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2o5j h GLU 1179CO 0.02 0.65 -0.47 0.00 -1.00 0.00 0.00 179.01 178.21 2o5j h ALA 1180N 1.25 0.82 0.00 3.43 0.00 -0.66 -3.48 119.26 120.62 2o5j h ALA 1180Ca 0.26 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2o5j h ALA 1180Cb -0.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2o5j h ALA 1180CO -0.05 0.66 0.00 0.41 0.00 0.00 0.00 179.25 180.27 2o5j n GLY 1181N 0.08 0.77 0.00 0.00 0.00 0.16 -5.07 105.19 101.13 2o5j n GLY 1181Ca -0.02 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2o5j n GLY 1181CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2o5j n GLU 1182N 0.00 0.49 -3.76 1.61 4.71 -1.04 -4.99 120.64 117.66 2o5j n GLU 1182Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.16 57.01 2o5j n GLU 1182Cb 0.00 -0.98 -0.15 0.00 -1.01 0.00 0.00 31.44 29.30 2o5j n GLU 1182CO 0.00 0.00 0.00 0.96 0.09 0.00 0.00 177.13 178.18 2o5j s ILE 1183N -1.94 -0.05 -0.21 -3.67 -4.36 -1.26 -5.01 121.20 104.70 2o5j s ILE 1183Ca 0.00 0.19 0.16 0.00 -0.26 0.00 0.00 60.65 60.74 2o5j s ILE 1183Cb 0.00 -0.16 -0.24 0.00 1.25 0.00 0.00 42.46 43.31 2o5j s ILE 1183CO 0.00 0.08 0.44 0.00 0.24 0.00 0.00 174.94 175.70 2o5j n GLN 1184N 4.13 0.81 -3.96 0.37 3.00 -1.26 -4.56 117.38 115.90 2o5j n GLN 1184Ca -0.26 -0.11 -0.15 0.00 -0.01 0.00 0.00 57.00 56.47 2o5j n GLN 1184Cb 0.51 -1.36 -0.04 0.00 0.00 0.00 0.00 30.24 29.36 2o5j n GLN 1184CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 2o5j n GLU 1185N -1.90 0.66 -3.73 -1.09 -0.58 -1.26 -2.89 120.64 109.85 2o5j n GLU 1185Ca -0.01 -2.81 -0.14 0.00 -0.42 0.00 0.00 57.16 53.77 2o5j n GLU 1185Cb 0.38 2.65 -0.15 0.00 -0.57 0.00 0.00 31.44 33.76 2o5j n GLU 1185CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2o5j s VAL 1186N -2.87 -0.10 -0.38 2.62 1.01 -0.29 -4.86 120.40 115.53 2o5j s VAL 1186Ca 0.30 0.22 -0.29 0.00 0.00 0.00 0.00 61.98 62.21 2o5j s VAL 1186Cb -0.01 -0.26 0.02 0.00 0.00 0.00 0.00 36.38 36.13 2o5j s VAL 1186CO 0.21 0.09 1.19 -2.16 0.00 0.00 0.00 175.10 174.43 2o5j s PRO 1187N 1.46 3.86 -0.04 2.72 0.04 -1.26 -1.05 135.00 140.73 2o5j s PRO 1187Ca -0.06 0.93 -0.06 0.00 0.04 0.00 0.00 61.00 61.85 2o5j s PRO 1187Cb -0.12 -3.86 0.01 0.00 0.04 0.00 0.00 34.50 30.58 2o5j s PRO 1187CO -0.06 -1.19 0.15 0.54 0.04 0.00 0.00 177.00 176.48 2o5j s VAL 1188N 4.28 0.02 0.26 -0.36 0.11 -0.37 -0.38 120.40 123.96 2o5j s VAL 1188Ca 0.50 -0.15 -0.31 0.00 -2.93 0.00 0.00 61.98 59.10 2o5j s VAL 1188Cb -0.12 -0.26 -0.12 0.00 -1.53 0.00 0.00 36.38 34.35 2o5j s VAL 1188CO 0.25 -0.08 1.65 0.54 -3.33 0.00 0.00 175.10 174.13 2o5j n ARG 1189N 2.67 2.75 -3.79 1.54 1.74 0.26 -2.24 116.66 119.59 2o5j n ARG 1189Ca -0.15 0.98 -0.13 0.00 -0.77 0.00 0.00 57.85 57.79 2o5j n ARG 1189Cb 0.58 -2.80 -0.09 0.00 -1.02 0.00 0.00 32.46 29.13 2o5j n ARG 1189CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2o5j s SER 1190N 0.78 -0.16 0.64 0.55 0.15 -1.24 -4.44 113.70 109.99 2o5j s SER 1190Ca 0.69 0.11 0.31 0.00 0.70 0.00 0.00 55.95 57.75 2o5j s SER 1190Cb -0.50 0.34 1.66 0.00 -1.71 0.00 0.00 66.02 65.81 2o5j s SER 1190CO 0.42 -0.35 1.97 -0.65 1.20 0.00 0.00 173.24 175.82 2o5j h PRO 1191N 4.36 0.00 0.00 5.44 0.11 -1.91 -0.08 132.00 139.93 2o5j h PRO 1191Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2o5j h PRO 1191Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2o5j h PRO 1191CO 0.39 0.00 0.07 -0.07 -0.21 0.00 0.00 178.00 178.18 2o5j h LEU 1192N 0.00 0.00 -3.60 2.35 3.38 -1.94 -3.00 115.31 112.50 2o5j h LEU 1192Ca 0.05 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.83 2o5j h LEU 1192Cb 0.70 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 41.08 2o5j h LEU 1192CO -0.00 0.00 -1.02 0.35 0.09 0.00 0.00 178.44 177.86 2o5j n THR 1193N -2.89 0.51 -1.72 0.22 -2.24 -0.04 -5.01 114.28 103.11 2o5j n THR 1193Ca -0.03 -1.68 -0.31 0.00 -2.27 0.00 0.00 64.05 59.77 2o5j n THR 1193Cb 0.13 0.95 0.04 0.00 -2.10 0.00 0.00 70.33 69.35 2o5j n THR 1193CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2o5j n GLN 1195N -3.04 0.66 -1.54 0.00 10.64 -1.26 -4.88 117.38 117.96 2o5j n GLN 1195Ca 0.07 0.19 -0.34 0.00 -1.83 0.00 0.00 57.00 55.08 2o5j n GLN 1195Cb 0.55 -1.55 -0.07 0.00 -0.86 0.00 0.00 30.24 28.31 2o5j n GLN 1195CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 2o5j n THR 1196N -3.41 -0.06 -0.06 -0.39 -1.04 -1.26 -4.83 114.28 103.23 2o5j n THR 1196Ca -0.44 -0.59 -0.02 0.00 -2.04 0.00 0.00 64.05 60.96 2o5j n THR 1196Cb 0.98 -2.12 -0.01 0.00 -1.82 0.00 0.00 70.33 67.36 2o5j n THR 1196CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2o5j n ARG 1197N 8.75 -0.06 -3.72 -2.82 -4.01 -1.26 -3.12 116.66 110.41 2o5j n ARG 1197Ca 0.46 0.76 -0.37 0.00 -1.04 0.00 0.00 57.85 57.65 2o5j n ARG 1197Cb 0.41 -1.14 -0.11 0.00 -3.04 0.00 0.00 32.46 28.58 2o5j n ARG 1197CO 0.00 0.00 0.00 0.71 -3.04 0.00 0.00 177.63 175.30 2o5j s TYR 1198N -3.47 3.54 0.00 2.89 4.12 -1.26 -4.98 117.35 118.18 2o5j s TYR 1198Ca -0.02 -2.26 0.00 0.00 0.02 0.00 0.00 57.07 54.81 2o5j s TYR 1198Cb 0.02 -3.25 0.00 0.00 -1.52 0.00 0.00 41.96 37.20 2o5j s TYR 1198CO 0.09 -0.97 0.00 0.41 0.02 0.00 0.00 175.55 175.10 2o5j n GLY 1199N 4.67 3.59 3.09 0.71 0.00 -1.18 -4.82 105.19 111.25 2o5j n GLY 1199Ca -0.04 -1.79 -0.21 0.00 0.00 0.00 0.00 46.02 43.97 2o5j n GLY 1199CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 1200N -2.37 1.04 0.80 1.61 1.01 -0.78 -4.36 120.40 117.34 2o5j s VAL 1200Ca 0.00 -0.58 -0.08 0.00 0.00 0.00 0.00 61.98 61.31 2o5j s VAL 1200Cb 0.00 -0.87 0.13 0.00 0.00 0.00 0.00 36.38 35.64 2o5j s VAL 1200CO 0.00 0.27 1.12 0.00 0.00 0.00 0.00 175.10 176.49 2o5j h GLN 1202N -0.94 0.81 0.00 0.00 4.15 -1.89 -2.06 115.11 115.18 2o5j h GLN 1202Ca -0.42 -0.38 -0.14 0.00 0.77 0.00 0.00 58.65 58.48 2o5j h GLN 1202Cb 1.27 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.94 2o5j h GLN 1202CO 0.47 1.02 -0.65 0.87 -1.93 0.00 0.00 178.83 178.61 2o5j h LYS 1203N 0.60 0.00 -0.02 1.69 1.79 -1.93 -3.02 116.57 115.68 2o5j h LYS 1203Ca 0.07 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.37 2o5j h LYS 1203Cb 0.81 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.48 2o5j h LYS 1203CO 0.07 0.65 -0.65 0.00 -1.08 0.00 0.00 179.45 178.43 2o5j n TYR 1205N -4.16 0.00 0.00 0.00 9.36 -0.78 -3.71 117.16 117.87 2o5j n TYR 1205Ca -0.10 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.12 2o5j n TYR 1205Cb 0.69 -0.14 0.00 0.00 -0.63 0.00 0.00 39.34 39.26 2o5j n TYR 1205CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2o5j n GLY 1206N 0.56 0.01 0.00 2.98 0.00 -1.14 -4.75 105.19 102.84 2o5j n GLY 1206Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2o5j n GLY 1206CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2o5j n TYR 1207N 0.00 0.00 -1.54 1.61 -0.00 -1.01 -0.83 117.16 115.39 2o5j n TYR 1207Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.90 57.66 2o5j n TYR 1207Cb 0.00 -0.03 -0.09 0.00 -0.00 0.00 0.00 39.34 39.22 2o5j n TYR 1207CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.86 173.39 2o5j n ASP 1208N -2.41 1.37 -3.07 2.98 2.03 -1.26 -2.36 116.55 113.84 2o5j n ASP 1208Ca 0.00 -0.92 -0.10 0.00 0.52 0.00 0.00 54.79 54.29 2o5j n ASP 1208Cb 0.00 -1.42 0.05 0.00 -0.72 0.00 0.00 41.12 39.03 2o5j n ASP 1208CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2o5j n LEU 1209N 15.36 0.00 -0.00 -2.67 0.00 -1.26 -4.91 117.00 123.52 2o5j n LEU 1209Ca 0.49 -0.89 0.21 0.00 0.00 0.00 0.00 56.01 55.83 2o5j n LEU 1209Cb 0.39 -0.27 0.71 0.00 0.00 0.00 0.00 43.42 44.25 2o5j n LEU 1209CO 0.71 -0.70 1.19 0.28 0.00 0.00 0.00 177.39 178.87 2o5j h SER 1210N -0.25 0.00 -4.36 1.96 0.02 -1.92 -3.40 113.55 105.60 2o5j h SER 1210Ca -0.14 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.31 2o5j h SER 1210Cb 0.51 0.00 0.08 0.00 0.14 0.00 0.00 62.40 63.14 2o5j h SER 1210CO 0.15 0.00 0.39 -0.32 -1.14 0.00 0.00 176.83 175.91 2o5j s MET 1211N -4.91 2.96 0.00 3.45 0.00 -1.26 -3.83 119.30 115.71 2o5j s MET 1211Ca -0.05 0.74 0.26 0.00 0.00 0.00 0.00 55.69 56.64 2o5j s MET 1211Cb 0.19 -2.01 0.62 0.00 0.00 0.00 0.00 34.83 33.63 2o5j s MET 1211CO 0.69 -1.02 1.49 0.00 0.00 0.00 0.00 175.02 176.18 2o5j n ALA 1212N -3.05 3.36 -1.94 4.11 0.00 -1.26 -4.38 120.51 117.35 2o5j n ALA 1212Ca 0.07 -0.32 -0.25 0.00 0.00 0.00 0.00 53.44 52.94 2o5j n ALA 1212Cb 0.55 -1.17 0.06 0.00 0.00 0.00 0.00 19.45 18.89 2o5j n ALA 1212CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2o5j s ARG 1213N -2.96 2.26 0.78 0.00 1.70 -1.26 -4.67 118.95 114.82 2o5j s ARG 1213Ca 0.13 -0.35 -0.17 0.00 -0.47 0.00 0.00 55.73 54.86 2o5j s ARG 1213Cb 0.18 -2.23 -0.13 0.00 -0.57 0.00 0.00 34.95 32.20 2o5j s ARG 1213CO 0.66 -1.14 -0.38 -2.30 -1.08 0.00 0.00 175.30 171.06 2o5j n PRO 1214N -2.81 0.02 -2.04 3.89 -0.02 -1.25 -4.21 135.00 128.57 2o5j n PRO 1214Ca 0.08 0.01 -0.41 0.00 -2.02 0.00 0.00 63.50 61.16 2o5j n PRO 1214Cb 0.60 -1.11 -0.02 0.00 -0.02 0.00 0.00 33.50 32.95 2o5j n PRO 1214CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2o5j s VAL 1215N -2.01 2.72 -0.09 -1.45 1.01 -0.01 -4.76 120.40 115.82 2o5j s VAL 1215Ca 0.49 0.61 -0.22 0.00 0.00 0.00 0.00 61.98 62.87 2o5j s VAL 1215Cb -0.32 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2o5j s VAL 1215CO 0.74 0.10 0.63 -0.44 0.00 0.00 0.00 175.10 176.13 2o5j s SER 1216N 0.31 6.88 0.29 3.32 0.01 -1.26 -4.87 113.70 118.38 2o5j s SER 1216Ca 0.58 1.05 -0.29 0.00 1.31 0.00 0.00 55.95 58.61 2o5j s SER 1216Cb -0.41 -2.37 -0.13 0.00 0.21 0.00 0.00 66.02 63.31 2o5j s SER 1216CO 0.43 -0.10 1.16 -0.38 0.41 0.00 0.00 173.24 174.77 2o5j n ILE 1217N 3.84 1.79 -0.36 1.44 5.41 -1.26 -3.01 119.36 127.20 2o5j n ILE 1217Ca -0.03 -0.45 0.00 0.00 1.00 0.00 0.00 62.75 63.28 2o5j n ILE 1217Cb 0.51 -1.24 0.00 0.00 -0.71 0.00 0.00 39.64 38.20 2o5j n ILE 1217CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2o5j n GLY 1218N 1.24 0.89 3.86 7.39 0.00 0.29 -4.98 105.19 113.89 2o5j n GLY 1218Ca 0.09 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 2o5j n GLY 1218CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o5j s GLU 1219N -0.80 3.61 -1.31 1.61 2.56 -1.16 -3.14 118.70 120.06 2o5j s GLU 1219Ca 0.00 0.06 -0.15 0.00 0.00 0.00 0.00 54.97 54.88 2o5j s GLU 1219Cb 0.00 -3.20 0.11 0.00 2.00 0.00 0.00 34.13 33.04 2o5j s GLU 1219CO 0.00 0.75 1.78 0.00 -0.56 0.00 0.00 175.26 177.23 2o5j n ALA 1220N 1.93 4.34 -0.77 6.30 0.00 -1.26 -2.91 120.51 128.15 2o5j n ALA 1220Ca -0.18 -4.04 0.00 0.00 0.00 0.00 0.00 53.44 49.22 2o5j n ALA 1220Cb 0.54 -3.34 0.00 0.00 0.00 0.00 0.00 19.45 16.65 2o5j n ALA 1220CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2o5j n VAL 1221N 5.15 0.00 -0.14 0.00 0.31 -1.26 -2.74 118.33 119.65 2o5j n VAL 1221Ca 0.45 0.99 -0.02 0.00 -0.01 0.00 0.00 64.34 65.75 2o5j n VAL 1221Cb 0.42 -1.89 -0.01 0.00 -0.91 0.00 0.00 33.84 31.45 2o5j n VAL 1221CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2o5j n GLY 1222N -0.23 -0.83 0.42 2.92 0.00 -1.26 0.15 105.19 106.36 2o5j n GLY 1222Ca 0.00 0.41 -0.13 0.00 0.00 0.00 0.00 46.02 46.30 2o5j n GLY 1222CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2o5j h ILE 1223N 0.00 0.11 -0.96 -0.61 2.04 -1.71 0.45 117.51 116.83 2o5j h ILE 1223Ca 0.09 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.25 2o5j h ILE 1223Cb 0.18 0.11 -0.16 0.00 -0.74 0.00 0.00 36.82 36.21 2o5j h ILE 1223CO -0.34 0.00 0.33 0.58 0.00 0.00 0.00 178.15 178.72 2o5j h VAL 1224N -0.56 0.18 0.21 1.67 2.07 0.15 0.44 116.25 120.41 2o5j h VAL 1224Ca 0.05 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2o5j h VAL 1224Cb 0.66 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2o5j h VAL 1224CO -0.37 0.03 -0.10 0.00 0.02 0.00 0.00 177.57 177.15 2o5j h ALA 1225N 1.89 -0.28 -0.21 1.67 0.00 0.29 0.56 119.26 123.17 2o5j h ALA 1225Ca 0.67 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.48 2o5j h ALA 1225Cb 1.51 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.37 2o5j h ALA 1225CO -0.72 -0.56 -0.02 0.00 0.00 0.00 0.00 179.25 177.94 2o5j h ALA 1226N 0.28 0.16 -0.92 0.00 0.00 0.28 -0.84 119.26 118.22 2o5j h ALA 1226Ca -0.03 0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2o5j h ALA 1226Cb 0.36 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2o5j h ALA 1226CO 0.05 -0.45 0.60 1.96 0.00 0.00 0.00 179.25 181.41 2o5j h GLN 1227N 0.04 1.15 0.00 0.00 4.20 -0.26 -1.05 115.11 119.18 2o5j h GLN 1227Ca 0.10 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.69 2o5j h GLN 1227Cb 0.14 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 2o5j h GLN 1227CO -0.19 0.76 -0.25 0.66 -0.67 0.00 0.00 178.83 179.14 2o5j h SER 1228N 1.19 0.00 0.98 1.46 4.64 -0.11 -1.22 113.55 120.50 2o5j h SER 1228Ca 0.36 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.54 2o5j h SER 1228Cb -0.05 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 2o5j h SER 1228CO -0.10 0.25 -1.09 0.40 -0.87 0.00 0.00 176.83 175.42 2o5j h ILE 1229N 0.00 0.61 0.12 0.95 2.04 -0.44 -3.29 117.51 117.51 2o5j h ILE 1229Ca -0.00 -2.04 -0.01 0.00 1.00 0.00 0.00 64.86 63.81 2o5j h ILE 1229Cb 0.49 2.15 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 2o5j h ILE 1229CO 0.03 0.35 -0.06 1.23 0.00 0.00 0.00 178.15 179.70 2o5j h GLY 1230N 3.65 -0.17 -0.07 5.37 0.00 -0.87 -3.12 103.07 107.86 2o5j h GLY 1230Ca -0.10 0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.32 2o5j h GLY 1230CO 0.05 -0.06 -0.51 -2.09 0.00 0.00 0.00 176.54 173.93 2o5j h GLU 1231N -0.77 -0.55 -1.00 4.80 4.81 -1.39 0.24 114.58 120.72 2o5j h GLU 1231Ca -0.02 0.04 0.27 0.00 -0.13 0.00 0.00 59.36 59.53 2o5j h GLU 1231Cb 0.55 0.13 -0.06 0.00 0.63 0.00 0.00 28.75 30.00 2o5j h GLU 1231CO 0.03 -0.37 0.70 -1.35 -0.73 0.00 0.00 179.01 177.28 2o5j h PRO 1232N -0.57 0.15 -0.07 0.92 0.11 -1.67 0.39 132.00 131.25 2o5j h PRO 1232Ca 0.04 -0.01 -0.21 0.00 0.11 0.00 0.00 66.00 65.93 2o5j h PRO 1232Cb 0.68 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.77 2o5j h PRO 1232CO -0.42 0.10 -0.77 0.78 -0.21 0.00 0.00 178.00 177.48 2o5j h GLY 1233N 0.15 0.72 0.92 -0.55 0.00 -1.06 -2.65 103.07 100.60 2o5j h GLY 1233Ca 0.51 -1.12 0.00 0.00 0.00 0.00 0.00 47.33 46.71 2o5j h GLY 1233CO -0.10 1.00 0.00 2.41 0.00 0.00 0.00 176.54 179.85 2o5j n THR 1234N -4.02 0.00 -0.06 4.70 -1.04 0.61 -3.07 114.28 111.40 2o5j n THR 1234Ca -0.09 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.86 2o5j n THR 1234Cb 0.75 -0.49 -0.09 0.00 -1.82 0.00 0.00 70.33 68.68 2o5j n THR 1234CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2o5j n GLN 1235N -0.96 2.08 0.02 -2.82 6.02 0.10 -4.57 117.38 117.26 2o5j n GLN 1235Ca 0.21 -0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.25 2o5j n GLN 1235Cb 0.10 -1.29 -0.10 0.00 1.02 0.00 0.00 30.24 29.97 2o5j n GLN 1235CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2o5j n LEU 1236N -2.44 0.49 0.00 1.08 4.77 -1.01 -3.74 117.00 116.16 2o5j n LEU 1236Ca -0.19 0.20 0.11 0.00 -0.03 0.00 0.00 56.01 56.11 2o5j n LEU 1236Cb 0.86 0.07 0.12 0.00 -2.33 0.00 0.00 43.42 42.14 2o5j n LEU 1236CO 0.24 0.06 0.27 0.35 -1.33 0.00 0.00 177.39 176.98 2o5j n THR 1237N -2.63 0.00 0.17 -5.08 -2.24 -1.17 -3.56 114.28 99.77 2o5j n THR 1237Ca -0.09 -0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.81 2o5j n THR 1237Cb 0.73 0.52 -0.00 0.00 -2.10 0.00 0.00 70.33 69.47 2o5j n THR 1237CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2o5j n MET 1238N -1.51 0.55 0.01 -0.78 2.81 -1.26 -3.74 117.12 113.21 2o5j n MET 1238Ca 0.05 0.07 0.11 0.00 -1.81 0.00 0.00 57.70 56.13 2o5j n MET 1238Cb 0.33 -1.76 0.07 0.00 -0.71 0.00 0.00 33.22 31.15 2o5j n MET 1238CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35 2o5j n ARG 1239N -2.52 0.13 -0.05 0.03 0.63 -1.25 -3.90 116.66 109.74 2o5j n ARG 1239Ca 0.00 -0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.81 2o5j n ARG 1239Cb 0.53 -1.54 -0.14 0.00 0.45 0.00 0.00 32.46 31.75 2o5j n ARG 1239CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 2o5j n THR 1240N -1.72 1.56 0.11 5.15 -1.04 -1.23 -3.20 114.28 113.91 2o5j n THR 1240Ca 0.04 -0.78 -0.03 0.00 -2.04 0.00 0.00 64.05 61.23 2o5j n THR 1240Cb 0.38 -0.99 0.08 0.00 -1.82 0.00 0.00 70.33 67.98 2o5j n THR 1240CO 0.00 0.00 0.00 2.19 -0.64 0.00 0.00 175.07 176.62 2o5j h PHE 1241N 0.01 0.01 -0.00 -1.42 -5.15 -1.75 -3.24 116.94 105.39 2o5j h PHE 1241Ca -0.41 -0.01 -0.14 0.00 -0.20 0.00 0.00 57.97 57.21 2o5j h PHE 1241Cb 2.08 -0.00 -0.02 0.00 0.22 0.00 0.00 35.95 38.23 2o5j h PHE 1241CO 0.01 0.75 -0.66 1.25 -2.00 0.00 0.00 178.31 177.66 2o5j h HIS 1242N 0.01 0.01 0.00 6.09 2.76 -1.70 -3.42 115.15 118.89 2o5j h HIS 1242Ca -0.01 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 2o5j h HIS 1242Cb 1.31 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.27 2o5j h HIS 1242CO 0.00 0.66 0.00 0.25 -1.30 0.00 0.00 177.93 177.55 2o5j n THR 1243N -3.76 0.00 -0.59 6.26 -2.24 -1.19 -5.10 114.28 107.66 2o5j n THR 1243Ca -0.01 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2o5j n THR 1243Cb 0.65 1.34 0.00 0.00 -2.10 0.00 0.00 70.33 70.22 2o5j n THR 1243CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2o5j n GLY 1244N 0.17 0.40 0.00 3.38 0.00 -1.24 -4.93 105.19 102.96 2o5j n GLY 1244Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2o5j n GLY 1244CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o5j n GLY 1245N 0.00 -0.70 0.00 -0.02 0.00 -1.26 -4.95 105.19 98.25 2o5j n GLY 1245Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2o5j n GLY 1245CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2o5j n VAL 1246N 0.00 0.00 -0.25 1.61 0.31 -1.26 -4.54 118.33 114.20 2o5j n VAL 1246Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 2o5j n VAL 1246Cb 0.00 -0.67 0.05 0.00 -0.91 0.00 0.00 33.84 32.31 2o5j n VAL 1246CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2o5j h ALA 1247N -1.71 0.26 -0.91 3.52 0.00 -1.97 0.17 119.26 118.61 2o5j h ALA 1247Ca 0.00 0.24 0.20 0.00 0.00 0.00 0.00 54.91 55.36 2o5j h ALA 1247Cb 0.00 0.69 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 2o5j h ALA 1247CO 0.00 -0.53 0.60 0.78 0.00 0.00 0.00 179.25 180.10 2o5j h GLY 1248N -0.06 0.94 1.02 0.00 0.00 -1.98 -0.58 103.07 102.40 2o5j h GLY 1248Ca 0.31 -0.20 -0.05 0.00 0.00 0.00 0.00 47.33 47.39 2o5j h GLY 1248CO -0.76 -0.01 0.22 0.00 0.00 0.00 0.00 176.54 175.99 2o5j h ALA 1249N 1.61 0.86 -0.39 3.60 0.00 -1.19 -2.16 119.26 121.58 2o5j h ALA 1249Ca 0.48 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 2o5j h ALA 1249Cb 1.16 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2o5j h ALA 1249CO -0.19 0.52 -0.06 0.00 0.00 0.00 0.00 179.25 179.51 2o5j h ALA 1250N 1.09 0.54 0.15 0.00 0.00 -1.10 -2.46 119.26 117.47 2o5j h ALA 1250Ca 0.21 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.84 2o5j h ALA 1250Cb 0.27 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2o5j h ALA 1250CO -0.01 0.37 -0.41 -0.44 0.00 0.00 0.00 179.25 178.77 2o5j h ASP 1251N 0.55 -1.19 0.02 0.00 3.32 -1.05 0.28 116.42 118.36 2o5j h ASP 1251Ca 0.10 0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 2o5j h ASP 1251Cb 0.57 0.44 0.00 0.00 0.22 0.00 0.00 39.33 40.56 2o5j h ASP 1251CO 0.03 -0.49 -0.01 0.16 -1.72 0.00 0.00 179.24 177.21 2o5j h ILE 1252N -0.66 1.12 -0.42 0.35 3.07 -1.46 -1.72 117.51 117.79 2o5j h ILE 1252Ca 0.02 -0.45 -0.07 0.00 1.55 0.00 0.00 64.86 65.91 2o5j h ILE 1252Cb 0.68 1.42 -0.02 0.00 -0.27 0.00 0.00 36.82 38.63 2o5j h ILE 1252CO -0.22 0.12 -0.02 0.71 -1.05 0.00 0.00 178.15 177.68 2o5j h THR 1253N -0.23 1.23 -0.27 0.16 1.35 -1.35 -2.40 112.91 111.40 2o5j h THR 1253Ca -0.00 -0.97 -0.15 0.00 -0.55 0.00 0.00 66.41 64.74 2o5j h THR 1253Cb 0.21 0.94 -0.01 0.00 -1.73 0.00 0.00 68.15 67.57 2o5j h THR 1253CO 0.01 0.34 -0.45 1.56 -0.25 0.00 0.00 175.52 176.72 2o5j h GLN 1254N 0.65 0.69 0.73 4.72 4.20 -0.33 -3.23 115.11 122.52 2o5j h GLN 1254Ca 0.13 -0.38 -0.04 0.00 0.06 0.00 0.00 58.65 58.42 2o5j h GLN 1254Cb 0.44 0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.25 2o5j h GLN 1254CO 0.02 0.99 -0.35 0.78 -0.67 0.00 0.00 178.83 179.61 2o5j h GLY 1255N 0.95 -1.02 -0.35 3.46 0.00 -1.09 -2.01 103.07 103.02 2o5j h GLY 1255Ca 0.04 0.38 0.22 0.00 0.00 0.00 0.00 47.33 47.96 2o5j h GLY 1255CO 0.09 -0.37 0.24 1.41 0.00 0.00 0.00 176.54 177.91 2o5j h LEU 1256N -1.16 0.03 -0.58 3.11 4.07 -1.54 0.80 115.31 120.04 2o5j h LEU 1256Ca -0.10 0.18 -0.10 0.00 0.08 0.00 0.00 57.88 57.95 2o5j h LEU 1256Cb 0.77 0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.73 2o5j h LEU 1256CO 0.16 -0.12 -0.01 -0.65 -1.08 0.00 0.00 178.44 176.74 2o5j h PRO 1257N 0.24 1.03 -0.50 1.13 0.11 -1.57 -2.45 132.00 129.99 2o5j h PRO 1257Ca 0.53 -0.33 -0.10 0.00 0.11 0.00 0.00 66.00 66.20 2o5j h PRO 1257Cb 1.02 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 2o5j h PRO 1257CO -0.62 1.02 -0.06 -0.09 -0.21 0.00 0.00 178.00 178.04 2o5j h ARG 1258N 0.92 0.93 0.00 1.05 9.65 0.82 -0.59 114.38 127.16 2o5j h ARG 1258Ca 0.16 -0.33 0.00 0.00 -1.10 0.00 0.00 59.98 58.71 2o5j h ARG 1258Cb 0.57 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.08 2o5j h ARG 1258CO 0.03 0.98 0.00 0.28 2.80 0.00 0.00 179.97 184.07 2o5j n VAL 1259N -4.25 0.75 0.02 0.20 0.31 0.22 0.07 118.33 115.65 2o5j n VAL 1259Ca 0.01 0.08 -0.12 0.00 -0.01 0.00 0.00 64.34 64.30 2o5j n VAL 1259Cb 0.36 -0.98 -0.14 0.00 -0.91 0.00 0.00 33.84 32.17 2o5j n VAL 1259CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 2o5j h ILE 1260N 0.00 1.06 0.00 2.52 6.09 -1.03 -2.84 117.51 123.31 2o5j h ILE 1260Ca 0.00 -2.81 0.00 0.00 -1.37 0.00 0.00 64.86 60.68 2o5j h ILE 1260Cb 0.46 2.60 0.00 0.00 0.47 0.00 0.00 36.82 40.36 2o5j h ILE 1260CO 0.00 0.72 -0.07 -0.33 -3.07 0.00 0.00 178.15 175.40 2o5j h GLU 1261N 0.03 0.00 0.14 2.19 5.08 -0.52 -2.60 114.58 118.91 2o5j h GLU 1261Ca -0.24 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 57.80 2o5j h GLU 1261Cb 1.98 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.22 2o5j h GLU 1261CO 0.11 0.00 -1.59 -0.07 -1.00 0.00 0.00 179.01 176.46 2o5j h LEU 1262N 0.00 0.46 -0.12 1.33 4.07 -0.44 -3.33 115.31 117.28 2o5j h LEU 1262Ca 0.00 -0.66 -0.24 0.00 0.08 0.00 0.00 57.88 57.07 2o5j h LEU 1262Cb 0.97 -0.15 0.01 0.00 1.08 0.00 0.00 40.66 42.56 2o5j h LEU 1262CO 0.00 1.55 -0.95 -0.26 -1.08 0.00 0.00 178.44 177.70 2o5j h PHE 1263N 0.08 0.82 -3.35 1.13 -1.00 -1.57 -3.43 116.94 109.61 2o5j h PHE 1263Ca -0.27 -0.43 -0.55 0.00 2.81 0.00 0.00 57.97 59.52 2o5j h PHE 1263Cb 2.05 -0.10 -0.04 0.00 3.61 0.00 0.00 35.95 41.47 2o5j h PHE 1263CO 0.08 1.25 -0.03 -2.00 -1.61 0.00 0.00 178.31 175.99 2o5j s GLU 1264N -3.36 4.09 -0.24 1.51 -6.30 -0.98 -3.35 118.70 110.07 2o5j s GLU 1264Ca -0.08 0.63 -0.17 0.00 -2.50 0.00 0.00 54.97 52.85 2o5j s GLU 1264Cb 0.08 -3.00 -0.03 0.00 0.00 0.00 0.00 34.13 31.18 2o5j s GLU 1264CO 0.89 0.50 0.47 0.00 0.02 0.00 0.00 175.26 177.15 2o5j s ALA 1265N -1.38 3.57 0.02 6.30 0.00 -1.26 -4.58 121.76 124.43 2o5j s ALA 1265Ca 0.36 -0.60 -0.28 0.00 0.00 0.00 0.00 51.96 51.45 2o5j s ALA 1265Cb -0.16 -2.81 0.09 0.00 0.00 0.00 0.00 23.12 20.23 2o5j s ALA 1265CO 0.19 -0.61 0.75 0.50 0.00 0.00 0.00 175.76 176.59 2o5j s ARG 1266N 2.00 1.02 -0.12 0.00 3.52 -1.26 -4.98 118.95 119.13 2o5j s ARG 1266Ca 0.20 -0.15 -0.31 0.00 -0.13 0.00 0.00 55.73 55.34 2o5j s ARG 1266Cb -0.15 0.47 -0.09 0.00 -1.56 0.00 0.00 34.95 33.62 2o5j s ARG 1266CO 0.09 -0.40 2.05 2.89 -0.81 0.00 0.00 175.30 179.12 2o5j n ARG 1267N 0.15 2.20 -0.75 5.12 1.85 -1.26 -4.83 116.66 119.15 2o5j n ARG 1267Ca -0.15 0.74 -0.32 0.00 -1.00 0.00 0.00 57.85 57.12 2o5j n ARG 1267Cb 0.61 -2.91 0.14 0.00 -1.05 0.00 0.00 32.46 29.25 2o5j n ARG 1267CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2o5j n PRO 1268N 7.74 -0.62 0.00 2.89 -0.04 -1.26 -4.90 135.00 138.81 2o5j n PRO 1268Ca 0.26 -0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2o5j n PRO 1268Cb 0.37 -1.92 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 2o5j n PRO 1268CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2o5j n LYS 1269N -2.25 0.00 -3.09 0.54 5.02 -1.26 -3.84 118.16 113.27 2o5j n LYS 1269Ca 0.06 0.64 -0.44 0.00 -2.02 0.00 0.00 58.31 56.56 2o5j n LYS 1269Cb 0.55 -1.25 -0.06 0.00 -0.02 0.00 0.00 35.03 34.25 2o5j n LYS 1269CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2o5j s ALA 1270N -3.28 3.34 -0.96 7.82 0.00 -1.26 -5.13 121.76 122.29 2o5j s ALA 1270Ca 0.00 -1.69 -0.19 0.00 0.00 0.00 0.00 51.96 50.08 2o5j s ALA 1270Cb 0.00 -3.44 0.12 0.00 0.00 0.00 0.00 23.12 19.80 2o5j s ALA 1270CO 0.00 -2.11 1.20 0.15 0.00 0.00 0.00 175.76 174.99 2o5j s LYS 1271N 2.89 3.63 0.00 0.00 -0.14 -1.25 -4.65 119.74 120.21 2o5j s LYS 1271Ca 0.18 -1.72 0.00 0.00 -1.36 0.00 0.00 55.97 53.07 2o5j s LYS 1271Cb -0.18 -5.00 0.00 0.00 -1.68 0.00 0.00 37.83 30.97 2o5j s LYS 1271CO 0.13 -1.84 0.00 0.00 -0.76 0.00 0.00 175.35 172.88 2o5j n ALA 1329N 6.85 -1.58 -3.14 5.17 0.00 -1.26 -5.12 120.51 121.43 2o5j n ALA 1329Ca 0.26 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.58 2o5j n ALA 1329Cb 0.49 -0.44 -0.14 0.00 0.00 0.00 0.00 19.45 19.36 2o5j n ALA 1329CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2o5j s ILE 1330N -3.23 -0.01 -0.36 0.00 1.09 -1.26 -5.02 121.20 112.41 2o5j s ILE 1330Ca 0.00 0.05 -0.23 0.00 -1.10 0.00 0.00 60.65 59.37 2o5j s ILE 1330Cb 0.00 -0.12 0.01 0.00 -1.06 0.00 0.00 42.46 41.29 2o5j s ILE 1330CO 0.00 0.02 0.77 -0.62 -0.10 0.00 0.00 174.94 175.01 2o5j s ASP 1331N 0.31 6.54 0.18 3.58 -1.08 -1.26 -4.77 116.67 120.17 2o5j s ASP 1331Ca -0.02 0.34 -0.21 0.00 -0.52 0.00 0.00 52.55 52.14 2o5j s ASP 1331Cb -0.03 -2.39 0.11 0.00 -1.46 0.00 0.00 42.92 39.15 2o5j s ASP 1331CO -0.01 -0.71 1.59 -0.65 0.52 0.00 0.00 175.17 175.91 2o5j h PRO 1332N 8.46 -0.17 -0.22 4.34 0.11 -1.97 -1.64 132.00 140.91 2o5j h PRO 1332Ca -0.25 0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.93 2o5j h PRO 1332Cb 1.10 0.04 -0.07 0.00 0.11 0.00 0.00 31.00 32.18 2o5j h PRO 1332CO 0.90 -0.12 -0.23 0.45 -0.21 0.00 0.00 178.00 178.79 2o5j h HIS 1333N -0.18 -0.62 -0.34 0.65 3.86 -1.94 0.47 115.15 117.04 2o5j h HIS 1333Ca 0.22 0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.46 2o5j h HIS 1333Cb 0.54 0.31 -0.02 0.00 1.06 0.00 0.00 27.41 29.31 2o5j h HIS 1333CO -0.61 -0.31 0.19 1.96 0.86 0.00 0.00 177.93 180.02 2o5j h GLN 1334N -0.25 0.48 -0.90 2.45 4.20 -1.94 -2.58 115.11 116.57 2o5j h GLN 1334Ca 0.13 -0.05 0.07 0.00 0.06 0.00 0.00 58.65 58.85 2o5j h GLN 1334Cb 0.45 -0.09 -0.06 0.00 0.30 0.00 0.00 27.48 28.08 2o5j h GLN 1334CO -0.37 0.39 0.59 1.25 -0.67 0.00 0.00 178.83 180.02 2o5j h LEU 1335N 0.43 0.90 -0.38 1.46 6.46 -0.63 -0.79 115.31 122.76 2o5j h LEU 1335Ca 0.12 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.88 2o5j h LEU 1335Cb 0.05 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 39.78 2o5j h LEU 1335CO -0.02 0.57 0.20 0.25 -0.62 0.00 0.00 178.44 178.83 2o5j h LEU 1336N 1.01 0.47 -0.23 2.25 5.85 0.28 -1.16 115.31 123.79 2o5j h LEU 1336Ca 0.39 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 59.00 2o5j h LEU 1336Cb 0.21 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2o5j h LEU 1336CO -0.15 0.43 0.08 -0.08 -0.34 0.00 0.00 178.44 178.39 2o5j h GLU 1337N 0.48 0.35 0.15 1.25 4.57 -1.05 0.90 114.58 121.23 2o5j h GLU 1337Ca 0.13 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 2o5j h GLU 1337Cb 0.06 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 2o5j h GLU 1337CO -0.02 0.42 -0.07 0.00 -1.18 0.00 0.00 179.01 178.15 2o5j h ALA 1338N 0.92 -0.20 0.00 2.92 0.00 -1.10 -3.39 119.26 118.40 2o5j h ALA 1338Ca 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2o5j h ALA 1338Cb 0.20 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2o5j h ALA 1338CO -0.00 -0.21 -1.18 1.17 0.00 0.00 0.00 179.25 179.03 2o5j n LYS 1339N -4.89 0.29 0.00 0.00 4.81 -0.45 -5.10 118.16 112.81 2o5j n LYS 1339Ca -0.05 -0.04 0.00 0.00 -0.87 0.00 0.00 58.31 57.36 2o5j n LYS 1339Cb 0.17 -1.56 0.00 0.00 0.02 0.00 0.00 35.03 33.66 2o5j n LYS 1339CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2o5j n GLY 1340N 1.38 1.30 0.00 3.14 0.00 0.31 -4.84 105.19 106.48 2o5j n GLY 1340Ca 0.01 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.95 2o5j n GLY 1340CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2o5j n PRO 1341N 0.69 0.00 0.04 1.61 -0.02 -1.26 -3.71 135.00 132.35 2o5j n PRO 1341Ca 0.00 0.31 0.12 0.00 -2.02 0.00 0.00 63.50 61.91 2o5j n PRO 1341Cb 0.00 -1.20 0.18 0.00 -0.02 0.00 0.00 33.50 32.46 2o5j n PRO 1341CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2o5j n GLU 1342N -1.44 0.02 0.01 -0.52 1.02 -1.26 0.16 120.64 118.62 2o5j n GLU 1342Ca 0.00 0.83 -0.21 0.00 -0.02 0.00 0.00 57.16 57.76 2o5j n GLU 1342Cb 0.00 -2.15 -0.14 0.00 -0.02 0.00 0.00 31.44 29.13 2o5j n GLU 1342CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2o5j n ALA 1343N -1.72 0.90 0.15 0.62 0.00 -1.26 -3.46 120.51 115.74 2o5j n ALA 1343Ca 0.10 -0.59 -0.14 0.00 0.00 0.00 0.00 53.44 52.81 2o5j n ALA 1343Cb 1.07 -0.70 -0.08 0.00 0.00 0.00 0.00 19.45 19.75 2o5j n ALA 1343CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2o5j h VAL 1344N 0.07 0.77 -0.37 0.00 2.07 0.14 0.26 116.25 119.20 2o5j h VAL 1344Ca -0.42 -0.04 0.06 0.00 0.82 0.00 0.00 66.70 67.13 2o5j h VAL 1344Cb 2.04 0.80 -0.09 0.00 -1.52 0.00 0.00 31.29 32.52 2o5j h VAL 1344CO 0.09 0.01 -0.46 -0.08 0.02 0.00 0.00 177.57 177.15 2o5j h GLU 1345N -0.34 -0.36 0.00 1.57 4.81 -1.57 0.26 114.58 118.95 2o5j h GLU 1345Ca -0.03 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2o5j h GLU 1345Cb 0.26 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 2o5j h GLU 1345CO 0.05 -0.24 -0.12 -0.09 -0.73 0.00 0.00 179.01 177.88 2o5j h ARG 1346N -0.37 0.00 0.21 1.92 9.65 -1.56 -2.55 114.38 121.67 2o5j h ARG 1346Ca 0.11 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.98 2o5j h ARG 1346Cb 0.60 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.18 2o5j h ARG 1346CO -0.56 0.12 -0.10 -0.92 2.80 0.00 0.00 179.97 181.32 2o5j h TYR 1347N 0.00 -0.26 -0.32 2.20 3.20 0.20 -3.08 116.97 118.91 2o5j h TYR 1347Ca -0.00 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.94 2o5j h TYR 1347Cb 0.40 0.09 -0.08 0.00 1.54 0.00 0.00 36.73 38.68 2o5j h TYR 1347CO 0.00 0.11 -0.21 -0.07 -1.64 0.00 0.00 178.16 176.35 2o5j h LEU 1348N -0.94 -0.69 -0.05 2.82 4.07 -0.55 0.23 115.31 120.21 2o5j h LEU 1348Ca -0.03 0.14 0.02 0.00 0.08 0.00 0.00 57.88 58.09 2o5j h LEU 1348Cb 0.48 0.35 -0.04 0.00 1.08 0.00 0.00 40.66 42.53 2o5j h LEU 1348CO 0.05 -0.24 -0.39 0.58 -1.08 0.00 0.00 178.44 177.35 2o5j h VAL 1349N -0.17 0.00 -0.58 1.22 2.07 -1.58 0.12 116.25 117.33 2o5j h VAL 1349Ca 0.17 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.66 2o5j h VAL 1349Cb 0.43 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 2o5j h VAL 1349CO -0.43 0.00 0.27 -0.08 0.02 0.00 0.00 177.57 177.36 2o5j h GLU 1350N -0.46 0.84 -0.09 1.57 4.57 -1.42 -0.51 114.58 119.09 2o5j h GLU 1350Ca 0.02 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.05 2o5j h GLU 1350Cb 0.51 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.94 2o5j h GLU 1350CO -0.29 0.69 -0.04 1.49 -1.18 0.00 0.00 179.01 179.67 2o5j h GLU 1351N 0.79 0.12 -0.03 1.92 4.57 -0.34 -1.38 114.58 120.23 2o5j h GLU 1351Ca 0.20 -0.02 -0.14 0.00 -1.18 0.00 0.00 59.36 58.23 2o5j h GLU 1351Cb 0.13 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 28.71 2o5j h GLU 1351CO -0.02 0.18 -0.52 0.82 -1.18 0.00 0.00 179.01 178.29 2o5j h ILE 1352N 0.12 1.42 0.00 2.32 2.04 -0.04 -3.19 117.51 120.19 2o5j h ILE 1352Ca 0.03 -1.97 -0.01 0.00 1.00 0.00 0.00 64.86 63.91 2o5j h ILE 1352Cb 0.16 2.49 -0.00 0.00 -0.74 0.00 0.00 36.82 38.73 2o5j h ILE 1352CO 0.01 0.57 -0.05 1.56 0.00 0.00 0.00 178.15 180.24 2o5j h GLN 1353N -0.09 0.00 -0.60 2.37 1.08 -0.66 -2.94 115.11 114.26 2o5j h GLN 1353Ca -0.06 0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.23 2o5j h GLN 1353Cb 1.21 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.57 2o5j h GLN 1353CO 0.10 0.05 0.26 0.87 -0.95 0.00 0.00 178.83 179.16 2o5j h LYS 1354N 0.00 0.45 -0.19 1.46 1.79 -1.25 0.17 116.57 119.00 2o5j h LYS 1354Ca -0.00 -0.03 -0.15 0.00 -2.18 0.00 0.00 60.65 58.29 2o5j h LYS 1354Cb 0.11 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 2o5j h LYS 1354CO 0.01 0.30 -0.47 0.28 -1.08 0.00 0.00 179.45 178.49 2o5j h VAL 1355N 0.47 1.32 -0.35 0.50 2.07 -1.65 -2.85 116.25 115.76 2o5j h VAL 1355Ca 0.29 -1.70 -0.14 0.00 0.82 0.00 0.00 66.70 65.97 2o5j h VAL 1355Cb 0.31 1.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 2o5j h VAL 1355CO -0.26 0.53 -0.35 1.88 0.02 0.00 0.00 177.57 179.39 2o5j h TYR 1356N 0.35 0.94 -0.63 1.57 -1.99 -1.55 -2.61 116.97 113.04 2o5j h TYR 1356Ca -0.00 -0.26 -0.00 0.00 2.00 0.00 0.00 58.73 60.46 2o5j h TYR 1356Cb 1.08 -0.21 -0.03 0.00 2.00 0.00 0.00 36.73 39.57 2o5j h TYR 1356CO 0.09 1.03 0.39 0.00 -0.00 0.00 0.00 178.16 179.67 2o5j h ARG 1357N 0.66 0.85 0.00 4.88 3.08 -0.75 -1.64 114.38 121.46 2o5j h ARG 1357Ca 0.06 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2o5j h ARG 1357Cb 0.90 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.77 2o5j h ARG 1357CO 0.08 0.60 0.00 0.00 -1.07 0.00 0.00 179.97 179.58 2o5j n ALA 1358N -2.29 1.62 -0.42 0.04 0.00 -1.08 -1.93 120.51 116.44 2o5j n ALA 1358Ca 0.05 -0.05 0.04 0.00 0.00 0.00 0.00 53.44 53.48 2o5j n ALA 1358Cb 0.05 -1.18 0.05 0.00 0.00 0.00 0.00 19.45 18.37 2o5j n ALA 1358CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2o5j n GLN 1359N -1.35 2.31 0.00 0.00 1.13 -0.74 -5.00 117.38 113.72 2o5j n GLN 1359Ca 0.04 -1.89 0.00 0.00 -1.94 0.00 0.00 57.00 53.22 2o5j n GLN 1359Cb 0.10 -1.18 0.00 0.00 0.11 0.00 0.00 30.24 29.27 2o5j n GLN 1359CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2o5j n GLY 1360N -0.84 3.18 3.77 1.08 0.00 -0.81 -5.03 105.19 106.54 2o5j n GLY 1360Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 2o5j n GLY 1360CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o5j s VAL 1361N -1.75 3.04 -0.69 1.61 1.01 -0.70 -4.97 120.40 117.96 2o5j s VAL 1361Ca 0.00 0.88 0.05 0.00 0.00 0.00 0.00 61.98 62.92 2o5j s VAL 1361Cb 0.00 -3.50 0.18 0.00 0.00 0.00 0.00 36.38 33.06 2o5j s VAL 1361CO 0.00 0.09 0.54 0.29 0.00 0.00 0.00 175.10 176.02 2o5j n LYS 1362N 0.10 1.90 -4.18 2.72 5.02 -1.26 -3.95 118.16 118.51 2o5j n LYS 1362Ca 0.04 -4.48 -0.35 0.00 -2.02 0.00 0.00 58.31 51.51 2o5j n LYS 1362Cb 0.46 -2.26 -0.10 0.00 -0.02 0.00 0.00 35.03 33.11 2o5j n LYS 1362CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2o5j s LEU 1363N -1.61 3.67 0.34 -0.35 2.34 -1.26 -3.49 118.68 118.32 2o5j s LEU 1363Ca 0.28 0.08 -0.29 0.00 0.06 0.00 0.00 54.13 54.26 2o5j s LEU 1363Cb -0.00 -1.89 -0.12 0.00 -0.56 0.00 0.00 46.19 43.62 2o5j s LEU 1363CO -0.14 0.24 1.45 1.57 -1.06 0.00 0.00 176.35 178.41 2o5j n HIS 1364N 3.05 2.69 -0.19 3.48 -0.00 0.01 -4.85 115.22 119.41 2o5j n HIS 1364Ca -0.18 0.43 0.23 0.00 -0.00 0.00 0.00 57.72 58.20 2o5j n HIS 1364Cb 0.53 -2.51 0.61 0.00 -0.00 0.00 0.00 29.99 28.62 2o5j n HIS 1364CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.34 175.90 2o5j h ASP 1365N 3.38 0.20 -0.61 0.26 3.45 -1.90 -2.91 116.42 118.30 2o5j h ASP 1365Ca -0.48 0.02 0.06 0.00 0.43 0.00 0.00 57.03 57.06 2o5j h ASP 1365Cb 1.25 -0.02 -0.07 0.00 -0.56 0.00 0.00 39.33 39.93 2o5j h ASP 1365CO 0.68 0.08 -0.36 0.29 -1.57 0.00 0.00 179.24 178.36 2o5j n LYS 1366N -4.40 -0.27 0.19 3.56 5.02 -1.26 -1.38 118.16 119.63 2o5j n LYS 1366Ca 0.18 0.92 -0.15 0.00 -2.02 0.00 0.00 58.31 57.24 2o5j n LYS 1366Cb 0.78 -1.36 -0.07 0.00 -0.02 0.00 0.00 35.03 34.36 2o5j n LYS 1366CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2o5j h HIS 1367N 0.00 -0.92 -0.65 2.13 3.86 -1.89 -1.79 115.15 115.89 2o5j h HIS 1367Ca 0.10 0.01 0.10 0.00 -1.16 0.00 0.00 60.37 59.42 2o5j h HIS 1367Cb 0.25 0.36 -0.04 0.00 1.06 0.00 0.00 27.41 29.04 2o5j h HIS 1367CO -0.63 -0.47 0.43 0.82 0.86 0.00 0.00 177.93 178.94 2o5j h ILE 1368N -0.68 0.90 0.86 2.45 2.04 -1.40 -2.67 117.51 119.02 2o5j h ILE 1368Ca -0.01 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.64 2o5j h ILE 1368Cb 0.63 0.38 0.01 0.00 -0.74 0.00 0.00 36.82 37.09 2o5j h ILE 1368CO -0.09 0.09 -0.41 -0.33 0.00 0.00 0.00 178.15 177.40 2o5j h GLU 1369N 0.48 -1.12 -0.98 2.37 5.08 -0.79 -0.30 114.58 119.32 2o5j h GLU 1369Ca 0.30 0.08 0.34 0.00 -1.00 0.00 0.00 59.36 59.08 2o5j h GLU 1369Cb 0.54 0.25 -0.17 0.00 0.50 0.00 0.00 28.75 29.87 2o5j h GLU 1369CO -0.09 -0.74 0.38 0.82 -1.00 0.00 0.00 179.01 178.37 2o5j h ILE 1370N -1.17 0.11 0.37 3.13 1.08 -1.01 0.14 117.51 120.16 2o5j h ILE 1370Ca -0.12 -0.03 -0.02 0.00 -0.39 0.00 0.00 64.86 64.30 2o5j h ILE 1370Cb 0.89 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.65 2o5j h ILE 1370CO 0.19 0.02 -0.18 0.58 -0.69 0.00 0.00 178.15 178.08 2o5j h VAL 1371N 0.10 0.00 -0.54 1.67 2.07 -1.30 -3.26 116.25 114.99 2o5j h VAL 1371Ca 0.72 -0.26 0.16 0.00 0.82 0.00 0.00 66.70 68.14 2o5j h VAL 1371Cb 1.72 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 2o5j h VAL 1371CO -0.76 0.00 0.44 1.62 0.02 0.00 0.00 177.57 178.89 2o5j h VAL 1372N -0.76 0.58 -0.72 2.57 3.04 -0.02 0.12 116.25 121.06 2o5j h VAL 1372Ca -0.05 0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.62 2o5j h VAL 1372Cb 0.38 0.68 -0.03 0.00 -2.01 0.00 0.00 31.29 30.31 2o5j h VAL 1372CO 0.08 0.00 0.38 -0.09 -1.01 0.00 0.00 177.57 176.94 2o5j h ARG 1373N 0.00 1.01 0.00 4.17 2.43 -0.82 -1.97 114.38 119.20 2o5j h ARG 1373Ca 0.26 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2o5j h ARG 1373Cb 1.13 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 2o5j h ARG 1373CO -0.00 0.77 0.00 1.96 -1.51 0.00 0.00 179.97 181.18 2o5j h GLN 1374N 1.00 0.00 -0.00 0.20 1.08 -0.80 -1.11 115.11 115.48 2o5j h GLN 1374Ca 0.25 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.45 2o5j h GLN 1374Cb 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 2o5j h GLN 1374CO -0.04 0.00 -0.01 -1.33 -0.95 0.00 0.00 178.83 176.50 2o5j n MET 1375N -2.80 0.83 -0.64 1.46 2.81 -0.74 -3.36 117.12 114.67 2o5j n MET 1375Ca -0.00 -0.09 0.02 0.00 -1.81 0.00 0.00 57.70 55.81 2o5j n MET 1375Cb 0.19 -1.50 0.02 0.00 -0.71 0.00 0.00 33.22 31.22 2o5j n MET 1375CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 2o5j n MET 1376N -1.01 0.15 0.00 0.03 2.81 -0.46 0.51 117.12 119.15 2o5j n MET 1376Ca 0.20 -1.37 0.12 0.00 -1.81 0.00 0.00 57.70 54.84 2o5j n MET 1376Cb 0.19 -0.52 0.71 0.00 -0.71 0.00 0.00 33.22 32.89 2o5j n MET 1376CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 2o5j n LYS 1377N -0.06 0.90 -4.39 0.03 4.81 -0.97 -4.78 118.16 113.69 2o5j n LYS 1377Ca 0.03 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.21 2o5j n LYS 1377Cb 0.77 -1.42 -0.12 0.00 0.02 0.00 0.00 35.03 34.29 2o5j n LYS 1377CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2o5j s TYR 1378N -2.00 2.18 -0.01 5.64 1.51 -1.26 0.38 117.35 123.78 2o5j s TYR 1378Ca 0.36 -0.39 -0.15 0.00 -1.01 0.00 0.00 57.07 55.89 2o5j s TYR 1378Cb 0.17 -1.11 0.02 0.00 -0.11 0.00 0.00 41.96 40.93 2o5j s TYR 1378CO 0.28 0.42 0.30 0.14 -1.11 0.00 0.00 175.55 175.58 2o5j s VAL 1379N -1.59 0.06 0.45 0.71 -7.23 -0.56 -2.02 120.40 110.22 2o5j s VAL 1379Ca 0.17 -0.49 -0.06 0.00 -1.81 0.00 0.00 61.98 59.79 2o5j s VAL 1379Cb -0.08 -0.63 -0.04 0.00 0.56 0.00 0.00 36.38 36.19 2o5j s VAL 1379CO 0.08 -0.27 0.76 -1.61 -0.31 0.00 0.00 175.10 173.75 2o5j s GLU 1380N -1.40 3.60 -0.01 4.82 2.02 -0.79 -1.03 118.70 125.91 2o5j s GLU 1380Ca -0.13 0.24 0.03 0.00 0.02 0.00 0.00 54.97 55.13 2o5j s GLU 1380Cb -0.05 -2.40 -0.03 0.00 0.10 0.00 0.00 34.13 31.74 2o5j s GLU 1380CO 0.04 -0.13 -0.08 0.08 0.02 0.00 0.00 175.26 175.19 2o5j s VAL 1381N -2.60 3.53 0.00 2.63 1.01 -0.92 -0.82 120.40 123.23 2o5j s VAL 1381Ca 0.48 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.70 2o5j s VAL 1381Cb -0.10 -2.50 0.00 0.00 0.00 0.00 0.00 36.38 33.77 2o5j s VAL 1381CO 0.40 0.44 0.00 0.35 0.00 0.00 0.00 175.10 176.30 2o5j n THR 1382N 1.74 0.00 -3.65 3.92 -2.24 0.25 -3.80 114.28 110.50 2o5j n THR 1382Ca -0.16 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.32 2o5j n THR 1382Cb 0.53 0.09 -0.14 0.00 -2.10 0.00 0.00 70.33 68.71 2o5j n THR 1382CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2o5j s ASP 1383N -1.97 3.64 1.12 3.42 -1.08 -0.72 -4.92 116.67 116.16 2o5j s ASP 1383Ca 0.00 -2.04 -0.13 0.00 -0.52 0.00 0.00 52.55 49.86 2o5j s ASP 1383Cb 0.00 -0.77 0.26 0.00 -1.46 0.00 0.00 42.92 40.94 2o5j s ASP 1383CO 0.00 -0.35 1.05 -2.84 0.52 0.00 0.00 175.17 173.55 2o5j s PRO 1384N 1.13 -0.55 0.00 4.34 0.02 -1.26 -2.97 135.00 135.71 2o5j s PRO 1384Ca 0.14 0.80 0.00 0.00 0.02 0.00 0.00 61.00 61.96 2o5j s PRO 1384Cb -0.21 -1.60 0.00 0.00 0.02 0.00 0.00 34.50 32.71 2o5j s PRO 1384CO -0.12 -3.47 0.00 0.41 -0.33 0.00 0.00 177.00 173.49 2o5j n GLY 1385N 0.34 -1.28 0.10 0.52 0.00 -1.26 -4.83 105.19 98.78 2o5j n GLY 1385Ca 0.04 0.30 -0.19 0.00 0.00 0.00 0.00 46.02 46.17 2o5j n GLY 1385CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2o5j h ASP 1386N 0.00 0.21 -4.38 1.61 3.58 -1.96 -3.48 116.42 112.00 2o5j h ASP 1386Ca 0.00 -0.84 -0.32 0.00 0.42 0.00 0.00 57.03 56.29 2o5j h ASP 1386Cb 0.00 -0.07 -0.18 0.00 1.72 0.00 0.00 39.33 40.80 2o5j h ASP 1386CO 0.00 1.38 -0.73 -0.44 -2.88 0.00 0.00 179.24 176.57 2o5j s SER 1387N -6.76 1.46 0.54 2.28 0.01 -1.26 -5.13 113.70 104.84 2o5j s SER 1387Ca -0.20 -0.81 -0.18 0.00 1.31 0.00 0.00 55.95 56.06 2o5j s SER 1387Cb 0.02 0.01 -0.14 0.00 0.21 0.00 0.00 66.02 66.12 2o5j s SER 1387CO 0.72 -0.26 -0.02 0.54 0.41 0.00 0.00 173.24 174.62 2o5j n ARG 1388N 0.56 0.09 0.00 12.44 5.12 -1.26 -4.62 116.66 128.99 2o5j n ARG 1388Ca -0.16 0.04 0.00 0.00 -1.93 0.00 0.00 57.85 55.80 2o5j n ARG 1388Cb 0.58 -1.14 0.00 0.00 -1.16 0.00 0.00 32.46 30.74 2o5j n ARG 1388CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 2o5j n LEU 1389N 2.14 0.00 -4.50 0.55 -0.00 -1.26 -4.50 117.00 109.42 2o5j n LEU 1389Ca 0.08 0.22 -0.41 0.00 -0.00 0.00 0.00 56.01 55.90 2o5j n LEU 1389Cb 0.47 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.81 2o5j n LEU 1389CO 0.53 0.00 2.06 0.18 -0.00 0.00 0.00 177.39 180.17 2o5j n LEU 1390N -0.32 1.40 -3.56 1.47 4.77 -1.25 -3.86 117.00 115.65 2o5j n LEU 1390Ca 0.00 -0.03 -0.16 0.00 -0.03 0.00 0.00 56.01 55.80 2o5j n LEU 1390Cb 0.00 -1.23 -0.06 0.00 -2.33 0.00 0.00 43.42 39.80 2o5j n LEU 1390CO 0.00 -1.05 0.51 -0.70 -1.33 0.00 0.00 177.39 174.82 2o5j s GLU 1391N 8.14 0.91 -0.25 3.23 2.12 -1.26 -4.96 118.70 126.63 2o5j s GLU 1391Ca 1.16 0.39 -0.02 0.00 0.36 0.00 0.00 54.97 56.86 2o5j s GLU 1391Cb -0.78 0.43 0.02 0.00 0.26 0.00 0.00 34.13 34.06 2o5j s GLU 1391CO 0.41 -0.25 -0.04 0.20 -0.54 0.00 0.00 175.26 175.03 2o5j s GLY 1392N -0.82 1.64 0.28 -1.50 0.00 -1.26 -2.17 107.32 103.48 2o5j s GLY 1392Ca -0.07 -1.43 0.02 0.00 0.00 0.00 0.00 44.72 43.24 2o5j s GLY 1392CO 0.06 0.53 0.26 1.62 0.00 0.00 0.00 173.10 175.57 2o5j s GLN 1393N 1.36 1.55 -0.22 2.90 -0.44 -0.20 -4.93 119.66 119.68 2o5j s GLN 1393Ca 0.01 -1.79 -0.30 0.00 -2.50 0.00 0.00 55.36 50.78 2o5j s GLN 1393Cb -0.16 0.33 -0.07 0.00 -1.64 0.00 0.00 33.01 31.46 2o5j s GLN 1393CO -0.04 -0.57 2.18 0.28 0.50 0.00 0.00 175.29 177.65 2o5j n VAL 1394N -0.47 0.35 -0.19 1.34 0.31 -1.26 -1.50 118.33 116.91 2o5j n VAL 1394Ca 0.04 -0.38 -0.11 0.00 -0.01 0.00 0.00 64.34 63.88 2o5j n VAL 1394Cb 0.64 -2.32 -0.09 0.00 -0.91 0.00 0.00 33.84 31.16 2o5j n VAL 1394CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2o5j h LEU 1395N 13.88 -1.72 -2.20 7.52 6.46 -0.39 0.40 115.31 139.26 2o5j h LEU 1395Ca -0.39 0.24 -0.01 0.00 -0.12 0.00 0.00 57.88 57.60 2o5j h LEU 1395Cb 1.26 0.72 -0.00 0.00 -0.73 0.00 0.00 40.66 41.91 2o5j h LEU 1395CO 0.97 -0.31 -0.03 -0.08 -0.62 0.00 0.00 178.44 178.37 2o5j h GLU 1396N -0.25 0.00 0.00 1.25 4.22 -1.91 0.14 114.58 118.03 2o5j h GLU 1396Ca 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.52 2o5j h GLU 1396Cb 0.47 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 2o5j h GLU 1396CO -0.61 0.03 -0.05 -0.22 -2.18 0.00 0.00 179.01 175.98 2o5j h LYS 1397N 0.00 0.00 0.02 1.92 1.63 -0.58 -1.83 116.57 117.72 2o5j h LYS 1397Ca -0.00 0.00 -0.24 0.00 -0.85 0.00 0.00 60.65 59.56 2o5j h LYS 1397Cb 0.07 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.67 2o5j h LYS 1397CO 0.00 0.05 -1.22 -1.49 -3.45 0.00 0.00 179.45 173.34 2o5j h TRP 1398N 0.00 0.07 0.00 1.91 4.06 -0.09 -3.06 115.95 118.84 2o5j h TRP 1398Ca -0.00 -0.05 -0.04 0.00 2.06 0.00 0.00 58.89 60.86 2o5j h TRP 1398Cb 0.38 -0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.54 2o5j h TRP 1398CO 0.00 1.05 -0.17 -0.44 -3.56 0.00 0.00 178.44 175.32 2o5j h ASP 1399N 0.01 0.00 0.06 -3.49 3.32 -0.94 -1.05 116.42 114.33 2o5j h ASP 1399Ca -0.10 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 2o5j h ASP 1399Cb 1.86 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.41 2o5j h ASP 1399CO 0.13 0.17 -0.03 0.58 -1.72 0.00 0.00 179.24 178.37 2o5j h VAL 1400N 0.00 1.25 0.57 -1.35 2.07 -1.44 -2.52 116.25 114.84 2o5j h VAL 1400Ca -0.00 -1.31 -0.03 0.00 0.82 0.00 0.00 66.70 66.19 2o5j h VAL 1400Cb 0.37 2.08 -0.00 0.00 -1.52 0.00 0.00 31.29 32.22 2o5j h VAL 1400CO 0.02 0.31 -0.35 -0.08 0.02 0.00 0.00 177.57 177.49 2o5j h GLU 1401N -0.70 -0.84 -1.00 1.57 4.22 -1.40 -2.52 114.58 113.92 2o5j h GLU 1401Ca -0.01 0.06 0.15 0.00 0.08 0.00 0.00 59.36 59.64 2o5j h GLU 1401Cb 0.58 0.19 -0.09 0.00 0.50 0.00 0.00 28.75 29.93 2o5j h GLU 1401CO 0.01 -0.56 0.62 0.00 -2.18 0.00 0.00 179.01 176.91 2o5j h ALA 1402N -1.39 1.59 0.61 2.92 0.00 -1.35 0.79 119.26 122.43 2o5j h ALA 1402Ca -0.08 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2o5j h ALA 1402Cb 0.69 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2o5j h ALA 1402CO 0.08 0.11 -0.44 1.25 0.00 0.00 0.00 179.25 180.25 2o5j h LEU 1403N 0.90 -1.16 -0.58 0.00 6.46 -1.31 -2.36 115.31 117.26 2o5j h LEU 1403Ca 0.53 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 58.36 2o5j h LEU 1403Cb 0.65 0.36 0.00 0.00 -0.73 0.00 0.00 40.66 40.94 2o5j h LEU 1403CO -0.31 -0.65 0.00 -1.13 -0.62 0.00 0.00 178.44 175.73 2o5j h ASN 1404N -1.02 0.00 0.87 1.25 -1.24 -1.21 -1.77 115.58 112.46 2o5j h ASN 1404Ca -0.07 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 56.83 2o5j h ASN 1404Cb 0.85 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.88 2o5j h ASN 1404CO 0.03 0.00 -0.51 -0.08 -1.29 0.00 0.00 177.43 175.58 2o5j h GLU 1405N 0.00 0.00 0.00 6.67 4.57 -0.57 0.40 114.58 125.65 2o5j h GLU 1405Ca 0.00 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 57.99 2o5j h GLU 1405Cb 0.73 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.29 2o5j h GLU 1405CO 0.00 0.51 -1.70 2.89 -1.18 0.00 0.00 179.01 179.53 2o5j n ARG 1406N -3.55 2.20 0.00 1.92 1.85 -0.91 -4.33 116.66 113.84 2o5j n ARG 1406Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2o5j n ARG 1406Cb 0.60 -1.26 0.00 0.00 -1.05 0.00 0.00 32.46 30.75 2o5j n ARG 1406CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2o5j n LEU 1407N -2.41 0.13 0.17 2.89 4.32 -0.67 -4.74 117.00 116.69 2o5j n LEU 1407Ca -0.17 0.31 -0.08 0.00 -0.02 0.00 0.00 56.01 56.05 2o5j n LEU 1407Cb 0.82 -0.47 -0.04 0.00 -1.62 0.00 0.00 43.42 42.12 2o5j n LEU 1407CO 0.21 -0.47 0.21 0.40 -1.22 0.00 0.00 177.39 176.52 2o5j h ILE 1408N 0.00 0.00 -3.17 -0.08 5.03 -1.70 -3.44 117.51 114.15 2o5j h ILE 1408Ca 0.00 -0.58 -0.60 0.00 -0.12 0.00 0.00 64.86 63.56 2o5j h ILE 1408Cb 0.00 0.00 -0.08 0.00 -3.03 0.00 0.00 36.82 33.71 2o5j h ILE 1408CO 0.00 0.00 -0.27 0.00 -0.68 0.00 0.00 178.15 177.20 2o5j s ALA 1409N -3.83 3.62 1.05 1.87 0.00 0.12 -5.05 121.76 119.54 2o5j s ALA 1409Ca -0.07 -0.36 -0.06 0.00 0.00 0.00 0.00 51.96 51.47 2o5j s ALA 1409Cb 0.01 -2.40 0.08 0.00 0.00 0.00 0.00 23.12 20.80 2o5j s ALA 1409CO 0.22 0.22 0.33 0.39 0.00 0.00 0.00 175.76 176.92 2o5j n GLU 1410N 3.00 -1.22 -1.66 0.00 4.71 -1.26 -3.56 120.64 120.65 2o5j n GLU 1410Ca -0.12 -0.53 -0.00 0.00 -0.01 0.00 0.00 57.16 56.50 2o5j n GLU 1410Cb 0.52 -0.44 0.00 0.00 -1.01 0.00 0.00 31.44 30.51 2o5j n GLU 1410CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2o5j n GLY 1411N 1.08 -2.15 3.55 0.62 0.00 -1.26 -4.84 105.19 102.20 2o5j n GLY 1411Ca 0.04 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 2o5j n GLY 1411CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j s LYS 1412N -0.59 2.75 -0.97 1.61 1.02 -1.26 -4.75 119.74 117.54 2o5j s LYS 1412Ca 0.01 0.03 -0.12 0.00 0.02 0.00 0.00 55.97 55.91 2o5j s LYS 1412Cb -0.00 -4.70 0.24 0.00 -0.52 0.00 0.00 37.83 32.85 2o5j s LYS 1412CO 0.10 -2.86 0.97 0.99 -0.92 0.00 0.00 175.35 173.63 2o5j s THR 1413N 8.70 5.71 -0.01 2.17 2.01 -1.26 -5.03 115.64 127.93 2o5j s THR 1413Ca 0.63 -2.85 -0.34 0.00 0.31 0.00 0.00 61.69 59.44 2o5j s THR 1413Cb -0.09 -4.57 -0.12 0.00 0.01 0.00 0.00 72.50 67.73 2o5j s THR 1413CO 0.09 -1.15 1.81 -2.65 -0.69 0.00 0.00 174.62 172.03 2o5j n PRO 1414N 3.64 2.22 -3.07 4.92 -0.02 -1.26 -4.86 135.00 136.57 2o5j n PRO 1414Ca 0.20 0.81 -0.45 0.00 -2.02 0.00 0.00 63.50 62.04 2o5j n PRO 1414Cb 0.44 -2.64 -0.02 0.00 -0.02 0.00 0.00 33.50 31.25 2o5j n PRO 1414CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2o5j s VAL 1415N 3.23 5.10 -0.21 -1.45 -7.23 -1.25 -4.63 120.40 113.95 2o5j s VAL 1415Ca 0.89 -2.05 -0.29 0.00 -1.81 0.00 0.00 61.98 58.71 2o5j s VAL 1415Cb -0.67 -4.69 -0.01 0.00 0.56 0.00 0.00 36.38 31.58 2o5j s VAL 1415CO 0.47 -1.35 1.23 0.00 -0.31 0.00 0.00 175.10 175.14 2o5j s ALA 1416N 1.59 3.60 0.44 1.32 0.00 -1.16 -4.89 121.76 122.66 2o5j s ALA 1416Ca 0.29 0.33 0.06 0.00 0.00 0.00 0.00 51.96 52.64 2o5j s ALA 1416Cb -0.06 -3.64 -0.05 0.00 0.00 0.00 0.00 23.12 19.37 2o5j s ALA 1416CO -0.08 -1.29 0.11 1.67 0.00 0.00 0.00 175.76 176.16 2o5j s TRP 1417N 3.65 2.34 -0.07 0.00 -2.14 -1.26 0.88 118.94 122.34 2o5j s TRP 1417Ca 0.53 -0.71 0.02 0.00 2.66 0.00 0.00 56.10 58.60 2o5j s TRP 1417Cb -0.19 -1.83 0.01 0.00 -3.10 0.00 0.00 33.47 28.36 2o5j s TRP 1417CO 0.15 0.22 -0.11 0.21 -2.66 0.00 0.00 176.95 174.76 2o5j s LYS 1418N -3.87 1.59 0.09 3.25 2.47 -0.00 -4.85 119.74 118.42 2o5j s LYS 1418Ca 0.31 -0.37 -0.32 0.00 -1.56 0.00 0.00 55.97 54.03 2o5j s LYS 1418Cb 0.05 -1.35 -0.12 0.00 -1.46 0.00 0.00 37.83 34.96 2o5j s LYS 1418CO 0.17 -0.00 1.78 -2.30 0.16 0.00 0.00 175.35 175.16 2o5j n PRO 1419N 3.90 2.51 -4.26 4.03 -0.02 -1.26 -1.88 135.00 138.02 2o5j n PRO 1419Ca -0.23 0.91 -0.34 0.00 -2.02 0.00 0.00 63.50 61.83 2o5j n PRO 1419Cb 0.51 -2.77 -0.11 0.00 -0.02 0.00 0.00 33.50 31.12 2o5j n PRO 1419CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2o5j s LEU 1420N 2.53 3.47 -0.70 2.45 0.20 -0.86 -4.85 118.68 120.92 2o5j s LEU 1420Ca 0.83 -0.04 -0.09 0.00 0.69 0.00 0.00 54.13 55.53 2o5j s LEU 1420Cb -0.57 -1.85 0.18 0.00 -0.43 0.00 0.00 46.19 43.52 2o5j s LEU 1420CO 0.40 0.18 0.58 -0.22 -0.29 0.00 0.00 176.35 177.01 2o5j s LEU 1421N 0.30 5.97 0.10 -0.68 2.96 -1.26 -4.27 118.68 121.80 2o5j s LEU 1421Ca -0.01 -2.70 -0.06 0.00 -0.22 0.00 0.00 54.13 51.15 2o5j s LEU 1421Cb -0.13 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.47 2o5j s LEU 1421CO 0.02 -0.49 0.35 0.00 -1.32 0.00 0.00 176.35 174.90 2o5j s MET 1422N 0.17 3.63 0.49 1.98 0.00 0.18 -4.91 119.30 120.85 2o5j s MET 1422Ca 0.16 -0.06 -0.19 0.00 0.00 0.00 0.00 55.69 55.61 2o5j s MET 1422Cb -0.16 -2.94 -0.08 0.00 0.00 0.00 0.00 34.83 31.65 2o5j s MET 1422CO -0.06 0.53 0.99 0.20 0.00 0.00 0.00 175.02 176.69 2o5j s GLY 1423N -2.15 2.26 0.15 3.16 0.00 -1.26 -4.24 107.32 105.24 2o5j s GLY 1423Ca 0.36 0.36 -0.20 0.00 0.00 0.00 0.00 44.72 45.24 2o5j s GLY 1423CO 0.22 0.65 1.24 1.55 0.00 0.00 0.00 173.10 176.76 2o5j n VAL 1424N -1.24 -0.49 -0.07 1.40 3.14 -1.21 -1.08 118.33 118.77 2o5j n VAL 1424Ca 0.08 1.92 -0.07 0.00 -2.96 0.00 0.00 64.34 63.30 2o5j n VAL 1424Cb 0.54 -2.44 -0.05 0.00 -1.06 0.00 0.00 33.84 30.83 2o5j n VAL 1424CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 2o5j h THR 1425N 0.00 0.00 -0.66 1.55 2.02 -1.84 -1.59 112.91 112.39 2o5j h THR 1425Ca 0.19 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.50 2o5j h THR 1425Cb 0.39 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.76 2o5j h THR 1425CO -0.77 0.00 0.44 0.11 0.37 0.00 0.00 175.52 175.67 2o5j h LYS 1426N -0.21 0.36 -0.62 6.66 1.79 -1.62 -0.20 116.57 122.74 2o5j h LYS 1426Ca 0.04 -0.02 -0.09 0.00 -2.18 0.00 0.00 60.65 58.40 2o5j h LYS 1426Cb 0.31 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.85 2o5j h LYS 1426CO -0.31 0.24 0.04 1.03 -1.08 0.00 0.00 179.45 179.36 2o5j h SER 1427N 0.37 1.04 -0.29 0.86 0.87 -0.18 -1.01 113.55 115.21 2o5j h SER 1427Ca 0.31 -0.29 -0.13 0.00 -1.23 0.00 0.00 61.79 60.46 2o5j h SER 1427Cb 0.72 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.40 2o5j h SER 1427CO -0.09 1.07 -0.32 0.00 -0.53 0.00 0.00 176.83 176.96 2o5j h ALA 1428N 1.00 0.42 0.03 6.23 0.00 -0.42 -3.20 119.26 123.33 2o5j h ALA 1428Ca 0.18 -0.42 0.03 0.00 0.00 0.00 0.00 54.91 54.70 2o5j h ALA 1428Cb 0.52 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2o5j h ALA 1428CO 0.02 0.47 -0.45 -0.07 0.00 0.00 0.00 179.25 179.22 2o5j h LEU 1429N 0.47 -1.38 -7.71 0.00 4.07 -0.93 -3.35 115.31 106.48 2o5j h LEU 1429Ca 0.04 0.16 -0.72 0.00 0.08 0.00 0.00 57.88 57.44 2o5j h LEU 1429Cb 0.90 0.53 -0.32 0.00 1.08 0.00 0.00 40.66 42.84 2o5j h LEU 1429CO 0.08 -0.49 -0.30 -0.94 -1.08 0.00 0.00 178.44 175.71 2o5j s SER 1430N -4.76 5.62 0.10 -0.43 1.04 -0.40 -4.76 113.70 110.11 2o5j s SER 1430Ca -0.16 -2.57 0.00 0.00 0.48 0.00 0.00 55.95 53.70 2o5j s SER 1430Cb 0.08 -1.95 -0.00 0.00 0.10 0.00 0.00 66.02 64.25 2o5j s SER 1430CO 0.63 -0.49 0.01 1.07 0.98 0.00 0.00 173.24 175.44 2o5j n THR 1431N 3.95 0.00 0.00 2.02 5.66 -1.21 -4.65 114.28 120.05 2o5j n THR 1431Ca 0.05 -0.49 0.00 0.00 -3.05 0.00 0.00 64.05 60.56 2o5j n THR 1431Cb 0.40 0.12 0.00 0.00 -1.55 0.00 0.00 70.33 69.31 2o5j n THR 1431CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 2o5j n LYS 1432N -0.24 0.00 -1.06 1.09 4.81 -1.26 -4.86 118.16 116.64 2o5j n LYS 1432Ca -0.03 0.35 -0.35 0.00 -0.87 0.00 0.00 58.31 57.41 2o5j n LYS 1432Cb 0.13 -0.96 0.09 0.00 0.02 0.00 0.00 35.03 34.32 2o5j n LYS 1432CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2o5j n SER 1433N -1.56 -1.40 -0.09 3.14 2.88 -1.26 -4.95 113.62 110.38 2o5j n SER 1433Ca 0.00 0.48 -0.15 0.00 -1.33 0.00 0.00 58.87 57.87 2o5j n SER 1433Cb 0.00 -1.23 -0.14 0.00 -0.75 0.00 0.00 64.21 62.09 2o5j n SER 1433CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 2o5j n TRP 1434N -2.95 0.28 -0.37 0.66 2.14 -1.26 -4.30 117.44 111.64 2o5j n TRP 1434Ca 0.09 0.07 0.01 0.00 2.07 0.00 0.00 57.50 59.74 2o5j n TRP 1434Cb 0.51 -1.04 0.07 0.00 -0.81 0.00 0.00 31.31 30.04 2o5j n TRP 1434CO 0.00 0.00 0.00 -0.07 2.07 0.00 0.00 177.69 179.69 2o5j h LEU 1435N 0.01 -1.27 -0.10 5.67 4.07 -1.96 0.93 115.31 122.64 2o5j h LEU 1435Ca -0.52 0.30 0.01 0.00 0.08 0.00 0.00 57.88 57.76 2o5j h LEU 1435Cb 2.04 0.71 -0.01 0.00 1.08 0.00 0.00 40.66 44.48 2o5j h LEU 1435CO -0.01 -0.30 0.01 0.77 -1.08 0.00 0.00 178.44 177.83 2o5j h SER 1436N -0.01 -0.01 0.20 -0.43 4.64 -1.93 -2.82 113.55 113.19 2o5j h SER 1436Ca 0.38 0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.65 2o5j h SER 1436Cb 0.63 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.74 2o5j h SER 1436CO -0.98 0.01 -0.27 0.00 -0.87 0.00 0.00 176.83 174.72 2o5j h ALA 1437N 1.08 1.43 0.00 5.18 0.00 -0.42 -1.55 119.26 124.97 2o5j h ALA 1437Ca 0.05 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2o5j h ALA 1437Cb 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2o5j h ALA 1437CO -0.07 0.41 0.00 0.00 0.00 0.00 0.00 179.25 179.59 2o5j n ALA 1438N -2.48 1.51 0.06 0.00 0.00 0.28 -3.09 120.51 116.78 2o5j n ALA 1438Ca -0.01 0.02 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 2o5j n ALA 1438Cb 0.35 -1.25 -0.15 0.00 0.00 0.00 0.00 19.45 18.40 2o5j n ALA 1438CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2o5j h SER 1439N 0.00 0.53 0.00 0.00 0.02 -1.19 -3.39 113.55 109.53 2o5j h SER 1439Ca 0.00 -0.92 0.00 0.00 -0.84 0.00 0.00 61.79 60.03 2o5j h SER 1439Cb 0.22 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.59 2o5j h SER 1439CO 0.00 1.53 0.00 0.33 -1.14 0.00 0.00 176.83 177.55 2o5j n PHE 1440N -3.98 0.00 0.00 3.45 -0.00 -1.18 -4.80 117.46 110.96 2o5j n PHE 1440Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.27 2o5j n PHE 1440Cb 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.39 2o5j n PHE 1440CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 176.76 177.70 2o5j n GLN 1441N -0.83 0.00 -3.96 -4.13 0.00 -1.25 -4.57 117.38 102.63 2o5j n GLN 1441Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.00 56.66 2o5j n GLN 1441Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 30.24 30.10 2o5j n GLN 1441CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 2o5j s ASN 1442N -2.81 4.59 0.35 1.69 2.47 -1.26 -4.92 114.94 115.05 2o5j s ASN 1442Ca 0.00 -1.18 0.09 0.00 0.42 0.00 0.00 52.86 52.19 2o5j s ASN 1442Cb 0.00 -1.66 0.83 0.00 -1.45 0.00 0.00 41.25 38.98 2o5j s ASN 1442CO 0.00 -0.20 1.83 0.71 -3.72 0.00 0.00 177.10 175.71 2o5j h THR 1443N 6.44 0.75 0.11 -5.21 1.35 -1.81 0.21 112.91 114.75 2o5j h THR 1443Ca -0.24 -0.23 0.01 0.00 -0.55 0.00 0.00 66.41 65.40 2o5j h THR 1443Cb 1.07 0.02 -0.05 0.00 -1.73 0.00 0.00 68.15 67.46 2o5j h THR 1443CO 0.53 0.12 -0.52 0.71 -0.25 0.00 0.00 175.52 176.11 2o5j h THR 1444N 0.68 0.02 0.47 6.82 1.35 -1.93 -2.35 112.91 117.98 2o5j h THR 1444Ca 0.51 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 66.35 2o5j h THR 1444Cb 0.89 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.34 2o5j h THR 1444CO -0.27 0.00 -0.23 -0.74 -0.25 0.00 0.00 175.52 174.03 2o5j h HIS 1445N -0.74 -0.59 -0.84 4.73 6.17 -1.82 -2.85 115.15 119.22 2o5j h HIS 1445Ca 0.00 -0.01 0.15 0.00 0.71 0.00 0.00 60.37 61.22 2o5j h HIS 1445Cb 0.75 0.19 -0.15 0.00 2.52 0.00 0.00 27.41 30.73 2o5j h HIS 1445CO -0.45 -0.28 -0.26 0.28 0.71 0.00 0.00 177.93 177.92 2o5j n VAL 1446N -5.22 -0.39 0.02 5.26 0.31 0.01 -0.51 118.33 117.82 2o5j n VAL 1446Ca -0.09 1.94 -0.19 0.00 -0.01 0.00 0.00 64.34 65.99 2o5j n VAL 1446Cb 0.29 -2.62 -0.11 0.00 -0.91 0.00 0.00 33.84 30.49 2o5j n VAL 1446CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2o5j h LEU 1447N 0.00 0.69 -0.77 7.52 4.07 -1.52 -3.01 115.31 122.29 2o5j h LEU 1447Ca 0.35 -0.75 0.10 0.00 0.08 0.00 0.00 57.88 57.66 2o5j h LEU 1447Cb 0.56 -0.21 -0.12 0.00 1.08 0.00 0.00 40.66 41.97 2o5j h LEU 1447CO -0.85 1.35 -0.48 0.74 -1.08 0.00 0.00 178.44 178.12 2o5j h THR 1448N 0.11 0.04 0.19 0.22 2.02 -0.54 0.17 112.91 115.11 2o5j h THR 1448Ca -0.10 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 2o5j h THR 1448Cb 1.47 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 2o5j h THR 1448CO 0.15 0.00 -0.09 -0.08 0.37 0.00 0.00 175.52 175.87 2o5j h GLU 1449N -0.14 -0.25 -0.25 6.66 4.57 -1.59 -2.73 114.58 120.86 2o5j h GLU 1449Ca 0.20 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 58.47 2o5j h GLU 1449Cb 0.53 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 2o5j h GLU 1449CO -0.81 -0.07 0.25 0.00 -1.18 0.00 0.00 179.01 177.20 2o5j h ALA 1450N 0.42 1.96 0.04 2.92 0.00 -1.16 -2.81 119.26 120.63 2o5j h ALA 1450Ca -0.03 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2o5j h ALA 1450Cb 0.29 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2o5j h ALA 1450CO 0.04 -0.38 -0.02 0.00 0.00 0.00 0.00 179.25 178.89 2o5j h ALA 1451N 1.74 -0.19 -0.04 0.00 0.00 -0.55 -1.93 119.26 118.28 2o5j h ALA 1451Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2o5j h ALA 1451Cb 0.62 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2o5j h ALA 1451CO -0.00 -0.19 -0.02 -0.89 0.00 0.00 0.00 179.25 178.15 2o5j n ILE 1452N -2.63 -0.03 -2.83 0.00 5.41 -1.04 -1.91 119.36 116.34 2o5j n ILE 1452Ca -0.01 0.30 -0.43 0.00 1.00 0.00 0.00 62.75 63.62 2o5j n ILE 1452Cb 0.02 -0.39 -0.04 0.00 -0.71 0.00 0.00 39.64 38.52 2o5j n ILE 1452CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2o5j s ALA 1453N -3.58 3.09 -0.98 -1.39 0.00 -1.07 -4.67 121.76 113.16 2o5j s ALA 1453Ca -0.00 -1.66 -0.28 0.00 0.00 0.00 0.00 51.96 50.01 2o5j s ALA 1453Cb 0.00 -3.87 -0.23 0.00 0.00 0.00 0.00 23.12 19.03 2o5j s ALA 1453CO 0.02 -2.73 2.62 0.41 0.00 0.00 0.00 175.76 176.08 2o5j n GLY 1454N 5.29 -0.46 3.69 0.00 0.00 -0.80 -4.64 105.19 108.26 2o5j n GLY 1454Ca -0.02 0.99 -0.38 0.00 0.00 0.00 0.00 46.02 46.61 2o5j n GLY 1454CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j s LYS 1455N 8.72 4.22 -0.65 1.61 -0.14 -0.73 -4.88 119.74 127.90 2o5j s LYS 1455Ca 1.34 0.27 -0.17 0.00 -1.36 0.00 0.00 55.97 56.05 2o5j s LYS 1455Cb -1.16 -3.51 0.14 0.00 -1.68 0.00 0.00 37.83 31.63 2o5j s LYS 1455CO 0.49 0.01 0.66 0.15 -0.76 0.00 0.00 175.35 175.90 2o5j s LYS 1456N 1.13 3.19 -0.80 1.68 1.02 -1.24 -3.10 119.74 121.62 2o5j s LYS 1456Ca 0.21 -1.78 -0.25 0.00 0.02 0.00 0.00 55.97 54.16 2o5j s LYS 1456Cb -0.15 -4.36 -0.00 0.00 -0.52 0.00 0.00 37.83 32.80 2o5j s LYS 1456CO 0.08 -1.41 1.65 0.34 -0.92 0.00 0.00 175.35 175.10 2o5j s ASP 1457N 3.27 5.72 0.04 2.83 -1.08 0.22 -4.79 116.67 122.88 2o5j s ASP 1457Ca 0.11 -0.49 -0.31 0.00 -0.52 0.00 0.00 52.55 51.34 2o5j s ASP 1457Cb -0.22 -2.55 -0.07 0.00 -1.46 0.00 0.00 42.92 38.62 2o5j s ASP 1457CO 0.00 -2.16 1.48 -1.61 0.52 0.00 0.00 175.17 173.41 2o5j s GLU 1458N 6.28 4.26 -0.49 4.34 2.02 -1.26 -2.78 118.70 131.06 2o5j s GLU 1458Ca 0.56 2.10 -0.25 0.00 0.02 0.00 0.00 54.97 57.40 2o5j s GLU 1458Cb -0.07 -3.52 0.03 0.00 0.10 0.00 0.00 34.13 30.67 2o5j s GLU 1458CO 0.07 -0.60 0.95 -0.51 0.02 0.00 0.00 175.26 175.19 2o5j s LEU 1459N 2.25 3.99 -0.07 1.80 1.02 -1.15 -4.95 118.68 121.57 2o5j s LEU 1459Ca 0.67 0.00 -0.06 0.00 0.02 0.00 0.00 54.13 54.77 2o5j s LEU 1459Cb -0.35 -3.11 0.02 0.00 0.02 0.00 0.00 46.19 42.77 2o5j s LEU 1459CO 0.29 -1.13 0.18 0.27 0.02 0.00 0.00 176.35 175.97 2o5j s ILE 1460N 3.90 -0.01 0.00 -0.59 -4.36 -1.26 -5.01 121.20 113.87 2o5j s ILE 1460Ca 0.36 0.03 0.00 0.00 -0.26 0.00 0.00 60.65 60.78 2o5j s ILE 1460Cb -0.10 -0.26 0.00 0.00 1.25 0.00 0.00 42.46 43.35 2o5j s ILE 1460CO 0.25 0.01 0.00 0.61 0.24 0.00 0.00 174.94 176.05 2o5j n GLY 1461N 3.21 2.37 0.12 6.27 0.00 -1.26 -4.82 105.19 111.08 2o5j n GLY 1461Ca -0.15 -1.89 -0.17 0.00 0.00 0.00 0.00 46.02 43.82 2o5j n GLY 1461CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2o5j h LEU 1462N 0.00 0.29 0.98 0.99 3.38 -1.91 -3.31 115.31 115.74 2o5j h LEU 1462Ca 0.00 -0.57 -0.05 0.00 0.09 0.00 0.00 57.88 57.35 2o5j h LEU 1462Cb 0.00 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 40.66 2o5j h LEU 1462CO 0.00 1.50 -0.47 0.50 0.09 0.00 0.00 178.44 180.06 2o5j h LYS 1463N 0.05 -1.27 -0.27 1.13 3.64 -1.90 -1.52 116.57 116.42 2o5j h LYS 1463Ca -0.34 0.09 0.06 0.00 -1.27 0.00 0.00 60.65 59.19 2o5j h LYS 1463Cb 2.03 0.29 -0.06 0.00 -0.41 0.00 0.00 32.23 34.08 2o5j h LYS 1463CO 0.11 -0.85 -0.10 1.05 -2.27 0.00 0.00 179.45 177.39 2o5j h GLU 1464N -1.32 -0.04 0.00 1.90 9.09 -1.88 -1.94 114.58 120.39 2o5j h GLU 1464Ca -0.14 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.28 2o5j h GLU 1464Cb 1.01 0.01 0.00 0.00 -1.65 0.00 0.00 28.75 28.12 2o5j h GLU 1464CO 0.22 -0.03 0.00 -0.97 0.05 0.00 0.00 179.01 178.28 2o5j h ASN 1465N -0.05 0.00 0.10 3.06 -1.24 -1.64 -2.76 115.58 113.06 2o5j h ASN 1465Ca 0.14 0.00 -0.20 0.00 0.71 0.00 0.00 56.30 56.95 2o5j h ASN 1465Cb 0.25 0.00 0.02 0.00 0.73 0.00 0.00 38.32 39.32 2o5j h ASN 1465CO -0.31 0.00 -0.83 0.58 -1.29 0.00 0.00 177.43 175.59 2o5j h VAL 1466N 0.00 1.45 -0.91 2.57 2.07 -0.46 -2.73 116.25 118.23 2o5j h VAL 1466Ca 0.00 -2.40 0.25 0.00 0.82 0.00 0.00 66.70 65.37 2o5j h VAL 1466Cb 0.30 2.96 -0.14 0.00 -1.52 0.00 0.00 31.29 32.89 2o5j h VAL 1466CO 0.00 0.69 0.37 0.40 0.02 0.00 0.00 177.57 179.05 2o5j h ILE 1467N -0.20 0.38 0.00 4.57 2.04 -1.34 1.33 117.51 124.29 2o5j h ILE 1467Ca -0.13 -0.11 -0.03 0.00 1.00 0.00 0.00 64.86 65.59 2o5j h ILE 1467Cb 1.60 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 37.71 2o5j h ILE 1467CO 0.16 0.06 -0.12 0.25 0.00 0.00 0.00 178.15 178.49 2o5j h LEU 1468N 0.31 0.00 0.26 1.44 6.46 -1.62 -3.46 115.31 118.70 2o5j h LEU 1468Ca 0.60 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 58.30 2o5j h LEU 1468Cb 1.21 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.13 2o5j h LEU 1468CO -0.59 0.12 -0.06 0.61 -0.62 0.00 0.00 178.44 177.90 2o5j n GLY 1469N -0.12 0.44 3.94 3.75 0.00 0.46 -5.02 105.19 108.63 2o5j n GLY 1469Ca -0.00 -0.87 -0.25 0.00 0.00 0.00 0.00 46.02 44.90 2o5j n GLY 1469CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2o5j s ARG 1470N -3.12 3.50 0.51 1.61 3.52 -1.03 -5.05 118.95 118.89 2o5j s ARG 1470Ca 0.00 -0.24 -0.22 0.00 -0.13 0.00 0.00 55.73 55.14 2o5j s ARG 1470Cb 0.00 -2.62 -0.08 0.00 -1.56 0.00 0.00 34.95 30.70 2o5j s ARG 1470CO 0.00 0.10 1.07 -0.11 -0.81 0.00 0.00 175.30 175.54 2o5j n LEU 1471N -1.83 3.54 -4.71 -0.88 7.94 -1.26 -4.61 117.00 115.19 2o5j n LEU 1471Ca -0.04 0.95 -0.42 0.00 -1.11 0.00 0.00 56.01 55.39 2o5j n LEU 1471Cb 0.56 -1.41 -0.03 0.00 0.53 0.00 0.00 43.42 43.07 2o5j n LEU 1471CO 0.49 -1.41 1.02 -0.63 -1.11 0.00 0.00 177.39 175.75 2o5j s ILE 1472N -1.36 3.67 -0.91 1.96 -1.09 -1.26 -4.88 121.20 117.32 2o5j s ILE 1472Ca 0.69 1.16 0.06 0.00 -2.23 0.00 0.00 60.65 60.33 2o5j s ILE 1472Cb -0.48 -3.74 0.06 0.00 -1.58 0.00 0.00 42.46 36.72 2o5j s ILE 1472CO 0.52 0.06 1.20 -2.65 -1.23 0.00 0.00 174.94 172.84 2o5j n PRO 1473N 4.37 0.02 -4.27 2.79 -0.02 -1.26 -3.44 135.00 133.18 2o5j n PRO 1473Ca 0.11 0.45 -0.23 0.00 -2.02 0.00 0.00 63.50 61.81 2o5j n PRO 1473Cb 0.44 -1.55 -0.12 0.00 -0.02 0.00 0.00 33.50 32.24 2o5j n PRO 1473CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2o5j s ALA 1474N -3.06 1.71 0.00 3.55 0.00 -1.26 -2.92 121.76 119.78 2o5j s ALA 1474Ca 0.02 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 50.75 2o5j s ALA 1474Cb 0.03 -0.21 0.00 0.00 0.00 0.00 0.00 23.12 22.94 2o5j s ALA 1474CO 0.10 0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.58 2o5j n GLY 1475N 1.04 1.04 0.08 0.00 0.00 -1.19 -4.11 105.19 102.06 2o5j n GLY 1475Ca -0.19 -0.96 0.12 0.00 0.00 0.00 0.00 46.02 44.99 2o5j n GLY 1475CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2o5j h THR 1476N 0.00 0.00 0.00 2.61 2.02 -1.89 -3.25 112.91 112.39 2o5j h THR 1476Ca 0.00 -0.66 -0.03 0.00 0.77 0.00 0.00 66.41 66.49 2o5j h THR 1476Cb 0.00 1.18 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2o5j h THR 1476CO 0.00 0.00 -0.84 1.23 0.37 0.00 0.00 175.52 176.28 2o5j h GLY 1477N 4.34 0.00 -6.01 2.16 0.00 -1.71 -3.24 103.07 98.61 2o5j h GLY 1477Ca 0.00 0.00 -0.78 0.00 0.00 0.00 0.00 47.33 46.55 2o5j h GLY 1477CO 0.00 0.00 0.25 -1.14 0.00 0.00 0.00 176.54 175.65 2o5j n SER 1478N -2.82 0.37 -0.14 0.19 3.41 -1.15 -4.32 113.62 109.16 2o5j n SER 1478Ca -0.01 1.11 0.23 0.00 -0.26 0.00 0.00 58.87 59.95 2o5j n SER 1478Cb 0.60 -0.86 0.65 0.00 -0.26 0.00 0.00 64.21 64.34 2o5j n SER 1478CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2o5j h ASP 1479N 3.47 0.12 0.49 4.04 3.45 -1.92 1.11 116.42 127.19 2o5j h ASP 1479Ca -0.46 0.01 -0.08 0.00 0.43 0.00 0.00 57.03 56.93 2o5j h ASP 1479Cb 1.34 -0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 40.09 2o5j h ASP 1479CO 0.72 0.05 -0.37 0.15 -1.57 0.00 0.00 179.24 178.22 2o5j h PHE 1480N 0.12 0.00 0.00 4.55 3.57 -1.94 -3.33 116.94 119.91 2o5j h PHE 1480Ca 0.38 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.88 2o5j h PHE 1480Cb 1.32 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.06 2o5j h PHE 1480CO -0.00 0.37 0.00 0.28 -2.23 0.00 0.00 178.31 176.73 2o5j n VAL 1481N -3.90 0.18 0.31 1.41 0.31 -0.23 -4.73 118.33 111.69 2o5j n VAL 1481Ca -0.01 -0.26 0.19 0.00 -0.01 0.00 0.00 64.34 64.25 2o5j n VAL 1481Cb 0.43 1.22 1.02 0.00 -0.91 0.00 0.00 33.84 35.60 2o5j n VAL 1481CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2o5j h ARG 1482N 0.00 0.00 -4.95 5.55 2.43 0.12 -3.36 114.38 114.17 2o5j h ARG 1482Ca 0.00 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.50 2o5j h ARG 1482Cb 0.60 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 29.79 2o5j h ARG 1482CO 0.00 0.00 -0.83 -0.06 -1.51 0.00 0.00 179.97 177.57 2o5j s PHE 1483N -4.26 2.93 -0.30 2.20 0.40 -1.26 -4.96 117.98 112.74 2o5j s PHE 1483Ca -0.04 -1.90 -0.13 0.00 -0.60 0.00 0.00 56.93 54.26 2o5j s PHE 1483Cb 0.12 -1.90 0.14 0.00 0.51 0.00 0.00 43.02 41.89 2o5j s PHE 1483CO 0.41 -0.83 0.81 0.99 0.70 0.00 0.00 175.22 177.29 2o5j s THR 1484N 1.23 -0.66 0.21 0.64 2.01 -1.26 -5.04 115.64 112.76 2o5j s THR 1484Ca -0.01 0.00 0.07 0.00 0.31 0.00 0.00 61.69 62.06 2o5j s THR 1484Cb -0.16 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.31 2o5j s THR 1484CO -0.10 0.00 0.10 0.00 -0.69 0.00 0.00 174.62 173.93 2o5j s GLN 1485N 2.53 2.69 0.09 4.92 -2.07 -1.26 -5.12 119.66 121.43 2o5j s GLN 1485Ca -0.05 -1.06 0.09 0.00 -1.82 0.00 0.00 55.36 52.52 2o5j s GLN 1485Cb -0.09 -2.47 -0.04 0.00 -1.09 0.00 0.00 33.01 29.32 2o5j s GLN 1485CO -0.18 0.44 -0.23 0.14 -1.32 0.00 0.00 175.29 174.13 2o5j s VAL 1486N -1.93 2.45 0.04 3.63 -7.23 -1.26 -5.14 120.40 110.96 2o5j s VAL 1486Ca 0.31 -1.51 -0.02 0.00 -1.81 0.00 0.00 61.98 58.95 2o5j s VAL 1486Cb -0.09 -2.05 -0.03 0.00 0.56 0.00 0.00 36.38 34.77 2o5j s VAL 1486CO 0.22 0.21 0.00 -0.69 -0.31 0.00 0.00 175.10 174.53 2o5j s VAL 1487N -0.99 0.17 -0.07 1.32 1.01 -1.26 -5.13 120.40 115.46 2o5j s VAL 1487Ca 0.14 -1.44 0.01 0.00 0.00 0.00 0.00 61.98 60.69 2o5j s VAL 1487Cb -0.10 -1.09 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 2o5j s VAL 1487CO 0.06 -0.79 -0.06 1.51 0.00 0.00 0.00 175.10 175.81 2o5j s ASP 1488N -2.42 4.68 0.57 3.32 -4.77 -1.26 -5.00 116.67 111.78 2o5j s ASP 1488Ca -0.01 -0.02 0.25 0.00 -3.30 0.00 0.00 52.55 49.48 2o5j s ASP 1488Cb 0.02 -1.18 1.37 0.00 -1.09 0.00 0.00 42.92 42.04 2o5j s ASP 1488CO -0.07 0.36 1.74 1.56 0.70 0.00 0.00 175.17 179.47 2o5j h GLN 1489N 5.21 0.00 -0.11 2.11 1.08 -2.01 0.11 115.11 121.51 2o5j h GLN 1489Ca -0.49 0.00 -0.23 0.00 -1.45 0.00 0.00 58.65 56.49 2o5j h GLN 1489Cb 1.17 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.61 2o5j h GLN 1489CO 0.52 0.00 -0.83 0.87 -0.95 0.00 0.00 178.83 178.45 2o5j h LYS 1490N 0.00 0.70 0.00 1.46 1.79 -2.01 -2.96 116.57 115.55 2o5j h LYS 1490Ca 0.00 -0.61 0.00 0.00 -2.18 0.00 0.00 60.65 57.86 2o5j h LYS 1490Cb 0.63 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 2o5j h LYS 1490CO 0.00 1.22 -0.40 2.41 -1.08 0.00 0.00 179.45 181.60 2o5j n THR 1491N -3.90 0.11 0.04 -0.16 -1.04 0.30 -3.12 114.28 106.52 2o5j n THR 1491Ca -0.08 -0.08 -0.20 0.00 -2.04 0.00 0.00 64.05 61.66 2o5j n THR 1491Cb 0.77 -0.04 -0.12 0.00 -1.82 0.00 0.00 70.33 69.13 2o5j n THR 1491CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2o5j h LEU 1492N 0.00 0.76 -0.23 -4.42 7.12 -1.28 -2.76 115.31 114.50 2o5j h LEU 1492Ca 0.00 -0.78 -0.15 0.00 0.13 0.00 0.00 57.88 57.08 2o5j h LEU 1492Cb 0.57 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 40.46 2o5j h LEU 1492CO 0.00 1.45 -0.43 0.11 -0.13 0.00 0.00 178.44 179.44 2o5j h LYS 1493N 0.16 0.70 -0.58 1.25 1.79 -1.63 -2.93 116.57 115.33 2o5j h LYS 1493Ca -0.13 -0.44 0.09 0.00 -2.18 0.00 0.00 60.65 57.99 2o5j h LYS 1493Cb 1.63 0.05 -0.07 0.00 -1.58 0.00 0.00 32.23 32.26 2o5j h LYS 1493CO 0.18 1.07 0.18 0.00 -1.08 0.00 0.00 179.45 179.80 2o5j h ALA 1494N 0.63 0.72 0.00 3.86 0.00 -1.61 0.44 119.26 123.30 2o5j h ALA 1494Ca 0.01 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 2o5j h ALA 1494Cb 1.03 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2o5j h ALA 1494CO 0.10 -0.23 -0.43 0.82 0.00 0.00 0.00 179.25 179.50 2o5j h ILE 1495N 0.35 1.22 0.00 0.00 5.03 -1.54 -2.20 117.51 120.37 2o5j h ILE 1495Ca 0.29 -1.53 -0.07 0.00 -0.12 0.00 0.00 64.86 63.43 2o5j h ILE 1495Cb 0.38 1.85 -0.01 0.00 -3.03 0.00 0.00 36.82 36.00 2o5j h ILE 1495CO -0.32 0.43 -0.35 -0.08 -0.68 0.00 0.00 178.15 177.15 2o5j h GLU 1496N 0.00 0.00 0.00 2.37 4.81 -0.96 -2.72 114.58 118.08 2o5j h GLU 1496Ca -0.00 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 2o5j h GLU 1496Cb 0.81 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 2o5j h GLU 1496CO 0.06 0.35 -0.24 0.93 -0.73 0.00 0.00 179.01 179.37 2o5j h GLU 1497N 0.00 0.00 0.02 1.92 4.39 -0.36 -1.77 114.58 118.78 2o5j h GLU 1497Ca -0.00 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.49 2o5j h GLU 1497Cb 0.90 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.53 2o5j h GLU 1497CO 0.05 0.24 -0.96 0.00 -1.16 0.00 0.00 179.01 177.18 2o5j h ALA 1498N 1.76 0.43 0.00 3.43 0.00 -1.18 -2.71 119.26 120.99 2o5j h ALA 1498Ca -0.00 -0.80 -0.19 0.00 0.00 0.00 0.00 54.91 53.91 2o5j h ALA 1498Cb 0.90 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 2o5j h ALA 1498CO 0.03 1.03 -0.91 0.00 0.00 0.00 0.00 179.25 179.40 2o5j h ARG 1499N 0.06 0.00 -0.02 0.00 3.08 -1.32 -3.27 114.38 112.90 2o5j h ARG 1499Ca -0.04 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.84 2o5j h ARG 1499Cb 1.64 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.68 2o5j h ARG 1499CO 0.14 0.91 -0.74 -0.22 -1.07 0.00 0.00 179.97 178.99 2o5j h LYS 1500N 0.00 0.16 0.00 0.04 3.64 -1.35 -2.91 116.57 116.15 2o5j h LYS 1500Ca -0.01 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 2o5j h LYS 1500Cb 1.68 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.53 2o5j h LYS 1500CO 0.12 0.83 0.00 -1.91 -2.27 0.00 0.00 179.45 176.22 2o5j n GLU 1501N -3.74 0.22 0.24 1.90 0.00 -1.02 -3.16 120.64 115.08 2o5j n GLU 1501Ca -0.02 0.08 0.16 0.00 0.00 0.00 0.00 57.16 57.38 2o5j n GLU 1501Cb 0.72 -1.50 0.60 0.00 0.00 0.00 0.00 31.44 31.25 2o5j n GLU 1501CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2o5j h ALA 1502N 2.98 1.00 -1.49 4.31 0.00 -1.56 -3.41 119.26 121.09 2o5j h ALA 1502Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2o5j h ALA 1502Cb 0.27 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 2o5j h ALA 1502CO 0.00 0.00 1.16 0.08 0.00 0.00 0.00 179.25 180.49 2o5j s VAL 1503N -3.55 3.65 0.30 0.00 1.01 -1.19 -4.99 120.40 115.63 2o5j s VAL 1503Ca 0.02 0.46 -0.29 0.00 0.00 0.00 0.00 61.98 62.17 2o5j s VAL 1503Cb 0.09 -4.46 -0.10 0.00 0.00 0.00 0.00 36.38 31.90 2o5j s VAL 1503CO 0.53 -1.33 1.29 -1.61 0.00 0.00 0.00 175.10 173.98 2o5j s GLU 1504N 5.99 4.39 0.00 2.72 0.41 -1.26 -5.13 118.70 125.81 2o5j s GLU 1504Ca 0.51 2.15 0.00 0.00 -0.41 0.00 0.00 54.97 57.21 2o5j s GLU 1504Cb -0.10 -3.11 0.00 0.00 -1.78 0.00 0.00 34.13 29.14 2o5j s GLU 1504CO 0.21 -0.16 0.00 0.00 -0.49 0.00 0.00 175.26 174.81