#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 1.23 -0.10 1.64 -2.85 -1.26 -5.02 119.74 113.38 2o5j s LYS 3 Ca 0.00 1.14 -0.18 0.00 -1.00 0.00 0.00 55.97 55.93 2o5j s LYS 3 Cb 0.00 -1.78 -0.04 0.00 -2.06 0.00 0.00 37.83 33.95 2o5j s LYS 3 CO 0.00 -2.35 0.49 -2.00 0.10 0.00 0.00 175.35 171.59 2o5j s GLU 4 N -4.79 4.32 -0.49 1.78 2.12 -1.26 -5.02 118.70 115.37 2o5j s GLU 4 Ca 0.64 0.48 -0.28 0.00 0.36 0.00 0.00 54.97 56.17 2o5j s GLU 4 Cb -0.20 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 30.77 2o5j s GLU 4 CO 0.58 0.19 1.56 0.08 -0.54 0.00 0.00 175.26 177.13 2o5j s VAL 5 N 0.50 3.68 -0.40 3.70 1.01 -1.26 -4.84 120.40 122.80 2o5j s VAL 5 Ca 0.27 0.62 0.12 0.00 0.00 0.00 0.00 61.98 62.99 2o5j s VAL 5 Cb -0.15 -4.14 -0.15 0.00 0.00 0.00 0.00 36.38 31.93 2o5j s VAL 5 CO 0.11 -0.87 0.44 0.54 0.00 0.00 0.00 175.10 175.32 2o5j n ARG 6 N 8.56 2.13 -3.74 2.72 1.74 -1.26 -4.99 116.66 121.82 2o5j n ARG 6 Ca 0.17 -0.04 -0.12 0.00 -0.77 0.00 0.00 57.85 57.09 2o5j n ARG 6 Cb 0.49 -1.15 -0.11 0.00 -1.02 0.00 0.00 32.46 30.67 2o5j n ARG 6 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2o5j s LYS 7 N -2.39 0.33 0.16 5.56 1.02 -1.26 -3.21 119.74 119.95 2o5j s LYS 7 Ca 0.02 0.52 0.07 0.00 0.02 0.00 0.00 55.97 56.60 2o5j s LYS 7 Cb 0.09 0.07 -0.04 0.00 -0.52 0.00 0.00 37.83 37.43 2o5j s LYS 7 CO 0.51 -0.09 -0.02 0.08 -0.92 0.00 0.00 175.35 174.90 2o5j s VAL 8 N 0.66 3.63 -0.17 3.17 1.01 -1.12 -4.91 120.40 122.68 2o5j s VAL 8 Ca -0.04 -1.42 -0.09 0.00 0.00 0.00 0.00 61.98 60.43 2o5j s VAL 8 Cb -0.05 -2.80 0.06 0.00 0.00 0.00 0.00 36.38 33.58 2o5j s VAL 8 CO -0.04 -0.08 0.40 -0.60 0.00 0.00 0.00 175.10 174.78 2o5j s ARG 9 N -2.83 0.38 -0.19 2.72 3.52 -1.25 0.52 118.95 121.82 2o5j s ARG 9 Ca 0.26 0.78 -0.12 0.00 -0.13 0.00 0.00 55.73 56.53 2o5j s ARG 9 Cb -0.09 -0.02 -0.05 0.00 -1.56 0.00 0.00 34.95 33.23 2o5j s ARG 9 CO 0.18 -0.16 0.21 0.42 -0.81 0.00 0.00 175.30 175.14 2o5j s ILE 10 N 1.43 5.35 0.02 4.11 1.01 -1.12 -4.94 121.20 127.06 2o5j s ILE 10 Ca -0.09 0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.91 2o5j s ILE 10 Cb -0.09 -3.55 -0.02 0.00 0.01 0.00 0.00 42.46 38.82 2o5j s ILE 10 CO -0.13 0.39 -0.02 0.00 0.00 0.00 0.00 174.94 175.18 2o5j s ALA 11 N 0.61 0.11 1.06 9.38 0.00 -1.26 -2.82 121.76 128.84 2o5j s ALA 11 Ca 0.12 -0.45 -0.12 0.00 0.00 0.00 0.00 51.96 51.51 2o5j s ALA 11 Cb -0.12 0.11 0.23 0.00 0.00 0.00 0.00 23.12 23.33 2o5j s ALA 11 CO 0.02 -0.11 1.07 -0.51 0.00 0.00 0.00 175.76 176.22 2o5j s LEU 12 N -1.10 1.56 -0.11 0.00 1.43 -1.26 -4.98 118.68 114.22 2o5j s LEU 12 Ca -0.12 1.69 -0.04 0.00 -1.03 0.00 0.00 54.13 54.64 2o5j s LEU 12 Cb -0.08 -3.79 -0.03 0.00 0.03 0.00 0.00 46.19 42.32 2o5j s LEU 12 CO -0.01 -3.71 0.03 0.00 0.23 0.00 0.00 176.35 172.89 2o5j s ALA 13 N -2.58 3.36 0.08 4.21 0.00 -1.26 -5.08 121.76 120.47 2o5j s ALA 13 Ca 0.67 -0.78 -0.21 0.00 0.00 0.00 0.00 51.96 51.64 2o5j s ALA 13 Cb -0.23 -1.62 -0.07 0.00 0.00 0.00 0.00 23.12 21.20 2o5j s ALA 13 CO 0.62 0.49 0.64 -1.12 0.00 0.00 0.00 175.76 176.39 2o5j s SER 14 N -0.59 7.13 0.31 0.00 0.01 -1.26 -4.80 113.70 114.50 2o5j s SER 14 Ca 0.10 1.34 0.07 0.00 1.31 0.00 0.00 55.95 58.77 2o5j s SER 14 Cb -0.12 -2.40 0.85 0.00 0.21 0.00 0.00 66.02 64.56 2o5j s SER 14 CO 0.02 0.21 1.65 -0.65 0.41 0.00 0.00 173.24 174.88 2o5j h PRO 15 N 4.79 0.24 -0.50 12.44 0.11 -1.93 0.72 132.00 147.87 2o5j h PRO 15 Ca -0.48 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 2o5j h PRO 15 Cb 1.21 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2o5j h PRO 15 CO 0.66 0.16 0.00 0.93 -0.21 0.00 0.00 178.00 179.54 2o5j h GLU 16 N 0.25 0.83 -0.19 1.05 3.07 -1.99 -1.09 114.58 116.51 2o5j h GLU 16 Ca 0.62 -0.23 -0.02 0.00 -0.50 0.00 0.00 59.36 59.23 2o5j h GLU 16 Cb 1.32 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 29.13 2o5j h GLU 16 CO -0.65 0.83 0.02 0.87 -1.40 0.00 0.00 179.01 178.68 2o5j h LYS 17 N 0.77 0.27 -0.05 2.33 1.57 -0.02 0.42 116.57 121.87 2o5j h LYS 17 Ca 0.15 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.93 2o5j h LYS 17 Cb 0.47 -0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.67 2o5j h LYS 17 CO 0.02 0.29 -0.35 0.82 -0.57 0.00 0.00 179.45 179.66 2o5j h ILE 18 N 0.27 0.25 -0.08 1.86 1.08 0.24 -0.34 117.51 120.79 2o5j h ILE 18 Ca 0.07 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 64.46 2o5j h ILE 18 Cb 0.16 0.25 -0.01 0.00 -3.07 0.00 0.00 36.82 34.15 2o5j h ILE 18 CO 0.00 0.00 -0.29 0.03 -0.69 0.00 0.00 178.15 177.20 2o5j h ARG 19 N -0.47 0.14 0.12 2.37 2.47 -1.11 -2.02 114.38 115.88 2o5j h ARG 19 Ca 0.07 -0.05 0.01 0.00 -1.26 0.00 0.00 59.98 58.75 2o5j h ARG 19 Cb 0.58 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.88 2o5j h ARG 19 CO -0.32 0.43 -0.13 0.66 0.56 0.00 0.00 179.97 181.18 2o5j h SER 20 N 0.13 -0.34 1.25 7.04 4.64 0.13 -1.57 113.55 124.84 2o5j h SER 20 Ca 0.02 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2o5j h SER 20 Cb 0.59 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2o5j h SER 20 CO 0.04 -0.19 0.00 -0.50 -0.87 0.00 0.00 176.83 175.31 2o5j h TRP 21 N -0.27 0.00 -4.29 4.77 6.55 -1.00 -3.46 115.95 118.25 2o5j h TRP 21 Ca 0.01 0.00 -0.50 0.00 0.95 0.00 0.00 58.89 59.34 2o5j h TRP 21 Cb 0.27 0.00 0.05 0.00 -0.86 0.00 0.00 29.16 28.62 2o5j h TRP 21 CO -0.13 0.00 0.39 0.45 -1.05 0.00 0.00 178.44 178.10 2o5j s SER 22 N -5.11 6.30 -0.09 -3.49 0.15 -0.59 -4.19 113.70 106.68 2o5j s SER 22 Ca 0.06 1.41 -0.02 0.00 0.70 0.00 0.00 55.95 58.10 2o5j s SER 22 Cb 0.09 -2.46 0.03 0.00 -1.71 0.00 0.00 66.02 61.97 2o5j s SER 22 CO 0.54 -0.81 0.00 -0.31 1.20 0.00 0.00 173.24 173.87 2o5j s TYR 23 N -3.06 0.73 0.30 3.44 1.51 -0.41 -4.93 117.35 114.92 2o5j s TYR 23 Ca 0.55 -0.27 0.00 0.00 -1.01 0.00 0.00 57.07 56.34 2o5j s TYR 23 Cb -0.11 -0.84 0.00 0.00 -0.11 0.00 0.00 41.96 40.90 2o5j s TYR 23 CO 0.50 -0.37 0.00 0.41 -1.11 0.00 0.00 175.55 174.98 2o5j n GLY 24 N 5.13 -1.64 3.08 0.71 0.00 -1.26 -4.38 105.19 106.82 2o5j n GLY 24 Ca -0.07 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.80 1.65 -0.31 1.61 2.12 -1.26 -3.33 118.70 116.38 2o5j s GLU 25 Ca 0.00 -0.50 -0.29 0.00 0.36 0.00 0.00 54.97 54.54 2o5j s GLU 25 Cb 0.00 -1.41 0.01 0.00 0.26 0.00 0.00 34.13 32.99 2o5j s GLU 25 CO 0.00 0.14 1.21 0.08 -0.54 0.00 0.00 175.26 176.15 2o5j s VAL 26 N 0.29 4.29 -0.47 3.70 1.01 -1.18 -4.87 120.40 123.18 2o5j s VAL 26 Ca -0.08 1.47 0.05 0.00 0.00 0.00 0.00 61.98 63.41 2o5j s VAL 26 Cb -0.13 -4.26 0.11 0.00 0.00 0.00 0.00 36.38 32.10 2o5j s VAL 26 CO 0.03 -0.48 0.99 -1.84 0.00 0.00 0.00 175.10 173.80 2o5j n GLU 27 N 7.14 2.07 -3.74 2.72 0.28 -1.26 -4.72 120.64 123.13 2o5j n GLU 27 Ca 0.14 -1.49 -0.13 0.00 -0.16 0.00 0.00 57.16 55.51 2o5j n GLU 27 Cb 0.47 -1.11 -0.10 0.00 1.43 0.00 0.00 31.44 32.12 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 -0.84 0.46 -0.82 3.44 2.20 -1.26 -5.01 119.74 117.90 2o5j s LYS 28 Ca 0.09 0.49 -0.06 0.00 -0.36 0.00 0.00 55.97 56.14 2o5j s LYS 28 Cb 0.05 0.22 -0.08 0.00 -1.51 0.00 0.00 37.83 36.51 2o5j s LYS 28 CO 0.07 -0.06 2.28 -0.35 -0.36 0.00 0.00 175.35 176.93 2o5j n PRO 29 N 2.78 2.12 -3.99 4.03 -0.04 -1.26 -3.88 135.00 134.75 2o5j n PRO 29 Ca -0.14 -1.38 -0.31 0.00 -0.04 0.00 0.00 63.50 61.63 2o5j n PRO 29 Cb 0.57 -2.37 -0.15 0.00 -0.04 0.00 0.00 33.50 31.52 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 2.93 1.46 0.00 0.54 0.41 -1.26 -5.00 118.70 117.78 2o5j s GLU 30 Ca 0.44 -1.73 0.00 0.00 -0.41 0.00 0.00 54.97 53.27 2o5j s GLU 30 Cb 0.13 -3.04 0.00 0.00 -1.78 0.00 0.00 34.13 29.44 2o5j s GLU 30 CO -0.03 -0.91 0.35 0.25 -0.49 0.00 0.00 175.26 174.44 2o5j n THR 31 N 4.34 0.00 -3.71 3.63 -2.24 -1.26 -3.25 114.28 111.79 2o5j n THR 31 Ca 0.01 0.69 -0.12 0.00 -2.27 0.00 0.00 64.05 62.37 2o5j n THR 31 Cb 0.42 -1.37 -0.10 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 -0.81 -0.01 -0.48 2.28 1.01 -1.26 -3.25 121.20 118.68 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 -0.63 0.04 0.00 0.01 0.00 0.00 42.46 41.88 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 0.74 6.27 0.01 3.58 3.84 -1.21 -4.89 114.94 123.28 2o5j s ASN 33 Ca -0.04 -0.63 -0.02 0.00 0.21 0.00 0.00 52.86 52.38 2o5j s ASN 33 Cb -0.05 -2.31 -0.00 0.00 -0.55 0.00 0.00 41.25 38.33 2o5j s ASN 33 CO -0.05 -0.86 0.13 0.00 -2.79 0.00 0.00 177.10 173.52 2o5j n TYR 34 N 6.29 -0.02 -0.24 0.43 0.18 -1.26 -1.02 117.16 121.51 2o5j n TYR 34 Ca -0.04 0.07 -0.03 0.00 1.88 0.00 0.00 57.90 59.77 2o5j n TYR 34 Cb 0.47 -0.30 -0.01 0.00 -0.38 0.00 0.00 39.34 39.11 2o5j n TYR 34 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2o5j n ARG 35 N -3.21 -0.20 -4.08 -3.48 5.12 -1.26 -3.20 116.66 106.36 2o5j n ARG 35 Ca 0.00 0.92 -0.33 0.00 -1.93 0.00 0.00 57.85 56.51 2o5j n ARG 35 Cb 0.01 -1.36 -0.15 0.00 -1.16 0.00 0.00 32.46 29.80 2o5j n ARG 35 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2o5j s THR 36 N -5.45 2.24 -0.43 0.55 2.01 -0.19 -4.99 115.64 109.39 2o5j s THR 36 Ca -0.08 -1.17 0.00 0.00 0.31 0.00 0.00 61.69 60.75 2o5j s THR 36 Cb 0.10 -2.10 0.00 0.00 0.01 0.00 0.00 72.50 70.51 2o5j s THR 36 CO 0.41 0.30 0.29 0.18 -0.69 0.00 0.00 174.62 175.11 2o5j n LEU 37 N 4.57 0.80 -4.91 4.42 4.77 -1.20 -3.91 117.00 121.54 2o5j n LEU 37 Ca -0.18 -0.40 -0.27 0.00 -0.03 0.00 0.00 56.01 55.13 2o5j n LEU 37 Cb 0.47 -0.19 0.01 0.00 -2.33 0.00 0.00 43.42 41.38 2o5j n LEU 37 CO 0.25 0.15 0.46 -0.75 -1.33 0.00 0.00 177.39 176.16 2o5j s LYS 38 N -0.07 3.43 0.32 3.23 2.20 -1.26 -4.89 119.74 122.70 2o5j s LYS 38 Ca 0.00 0.17 -0.29 0.00 -0.36 0.00 0.00 55.97 55.48 2o5j s LYS 38 Cb 0.00 -2.35 -0.12 0.00 -1.51 0.00 0.00 37.83 33.85 2o5j s LYS 38 CO 0.00 -0.30 1.50 -2.30 -0.36 0.00 0.00 175.35 173.89 2o5j n PRO 39 N -2.33 2.53 0.00 4.03 -0.02 -1.26 -3.36 135.00 134.59 2o5j n PRO 39 Ca 0.01 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 2o5j n PRO 39 Cb 0.56 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 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 1.43 0.00 0.00 -0.52 2.13 -1.20 -4.82 120.64 117.66 2o5j n GLU 40 Ca 0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.88 2o5j n GLU 40 Cb 0.36 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.07 2o5j n GLU 40 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 2o5j n ARG 41 N 0.00 0.68 -0.23 5.31 -4.01 -1.26 -4.87 116.66 112.28 2o5j n ARG 41 Ca 0.00 0.00 0.29 0.00 -1.04 0.00 0.00 57.85 57.10 2o5j n ARG 41 Cb 0.00 0.00 0.70 0.00 -3.04 0.00 0.00 32.46 30.12 2o5j n ARG 41 CO 0.00 0.00 0.00 -0.44 -3.04 0.00 0.00 177.63 174.15 2o5j h ASP 42 N 0.00 0.07 0.00 2.89 5.19 -1.91 -3.38 116.42 119.28 2o5j h ASP 42 Ca 0.00 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 2o5j h ASP 42 Cb 0.00 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2o5j h ASP 42 CO 0.00 0.02 0.00 0.61 -3.12 0.00 0.00 179.24 176.75 2o5j n GLY 43 N -1.69 0.00 0.00 2.75 0.00 -1.25 -3.99 105.19 101.01 2o5j n GLY 43 Ca 0.21 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.25 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 4.32 -1.20 -2.53 117.00 118.58 2o5j n LEU 44 Ca 0.00 0.43 0.00 0.00 -0.02 0.00 0.00 56.01 56.42 2o5j n LEU 44 Cb 0.00 -0.43 0.00 0.00 -1.62 0.00 0.00 43.42 41.37 2o5j n LEU 44 CO 0.00 -0.36 0.15 0.49 -1.22 0.00 0.00 177.39 176.44 2o5j n PHE 45 N -1.43 0.00 -1.39 -1.77 0.99 -1.26 -4.32 117.46 108.28 2o5j n PHE 45 Ca 0.02 0.00 -0.46 0.00 -0.00 0.00 0.00 57.45 57.00 2o5j n PHE 45 Cb 0.05 0.00 -0.02 0.00 -1.00 0.00 0.00 39.48 38.51 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 -0.28 -1.48 0.21 4.37 2.03 -1.05 -4.81 116.55 115.54 2o5j n ASP 46 Ca 0.00 1.05 0.09 0.00 0.52 0.00 0.00 54.79 56.45 2o5j n ASP 46 Cb 0.02 -0.96 0.30 0.00 -0.72 0.00 0.00 41.12 39.77 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 0.88 0.00 0.54 -0.67 3.07 -1.91 -3.06 114.58 113.44 2o5j h GLU 47 Ca -0.31 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.52 2o5j h GLU 47 Cb 1.43 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 29.35 2o5j h GLU 47 CO 0.55 0.21 -0.26 -0.09 -1.40 0.00 0.00 179.01 178.02 2o5j h ARG 48 N 0.00 -0.70 -0.03 2.33 2.43 -1.84 1.69 114.38 118.26 2o5j h ARG 48 Ca -0.00 0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2o5j h ARG 48 Cb 0.95 0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.65 2o5j h ARG 48 CO 0.03 -0.46 0.19 0.82 -1.51 0.00 0.00 179.97 179.04 2o5j h ILE 49 N -0.91 0.06 0.00 1.20 2.04 -1.79 -3.36 117.51 114.75 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 0.55 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2o5j h ILE 49 CO 0.12 0.00 -0.31 0.49 0.00 0.00 0.00 178.15 178.45 2o5j n PHE 50 N -3.08 0.00 0.00 1.37 0.99 -1.13 -4.44 117.46 111.16 2o5j n PHE 50 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.43 2o5j n PHE 50 Cb 0.26 0.27 0.00 0.00 -1.00 0.00 0.00 39.48 39.01 2o5j n PHE 50 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2o5j n GLY 51 N 2.00 3.34 3.66 1.37 0.00 0.57 -3.47 105.19 112.67 2o5j n GLY 51 Ca 0.00 -1.10 -0.52 0.00 0.00 0.00 0.00 46.02 44.40 2o5j n GLY 51 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2o5j n PRO 52 N -1.29 1.49 0.18 1.61 -0.02 -1.26 -4.33 135.00 131.37 2o5j n PRO 52 Ca 0.00 0.54 0.05 0.00 -2.02 0.00 0.00 63.50 62.07 2o5j n PRO 52 Cb 0.00 -2.25 0.28 0.00 -0.02 0.00 0.00 33.50 31.50 2o5j n PRO 52 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2o5j h ILE 53 N 4.45 0.89 -1.86 4.25 2.10 -1.90 -3.35 117.51 122.09 2o5j h ILE 53 Ca -0.47 -1.67 -0.61 0.00 1.08 0.00 0.00 64.86 63.19 2o5j h ILE 53 Cb 1.31 2.03 -0.13 0.00 -1.09 0.00 0.00 36.82 38.93 2o5j h ILE 53 CO 0.89 0.40 -0.62 -0.75 -1.08 0.00 0.00 178.15 176.99 2o5j s LYS 54 N -3.48 1.89 0.00 2.19 2.47 -1.26 -4.81 119.74 116.73 2o5j s LYS 54 Ca 0.01 -2.04 0.00 0.00 -1.56 0.00 0.00 55.97 52.38 2o5j s LYS 54 Cb 0.10 -1.58 0.00 0.00 -1.46 0.00 0.00 37.83 34.89 2o5j s LYS 54 CO 0.70 -0.01 0.00 -3.47 0.16 0.00 0.00 175.35 172.73 2o5j n ASP 55 N -0.89 0.00 0.01 1.43 -0.08 -1.26 -4.30 116.55 111.46 2o5j n ASP 55 Ca -0.05 0.00 0.11 0.00 -1.51 0.00 0.00 54.79 53.34 2o5j n ASP 55 Cb 0.66 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 44.05 2o5j n ASP 55 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 2o5j n TYR 56 N 0.00 0.12 -1.85 -0.67 0.53 -1.26 -4.07 117.16 109.95 2o5j n TYR 56 Ca 0.00 0.03 -0.33 0.00 -1.02 0.00 0.00 57.90 56.59 2o5j n TYR 56 Cb 0.00 -0.32 0.03 0.00 -1.03 0.00 0.00 39.34 38.03 2o5j n TYR 56 CO 0.00 0.00 0.00 -2.00 -1.02 0.00 0.00 176.86 173.84 2o5j s GLU 57 N -3.22 3.02 0.00 -0.72 -6.30 -1.24 -4.56 118.70 105.69 2o5j s GLU 57 Ca 0.02 1.26 0.00 0.00 -2.50 0.00 0.00 54.97 53.75 2o5j s GLU 57 Cb 0.15 -1.99 0.00 0.00 0.00 0.00 0.00 34.13 32.29 2o5j s GLU 57 CO 0.85 -1.06 0.00 0.00 0.02 0.00 0.00 175.26 175.07 2o5j h ALA 59 N -1.22 -0.44 0.13 0.00 0.00 -1.93 -3.39 119.26 112.41 2o5j h ALA 59 Ca 0.00 -0.08 -0.29 0.00 0.00 0.00 0.00 54.91 54.54 2o5j h ALA 59 Cb 0.00 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2o5j h ALA 59 CO 0.00 -0.42 -1.38 0.00 0.00 0.00 0.00 179.25 177.45 2o5j n GLY 61 N 1.60 1.45 0.13 0.00 0.00 -1.26 -5.02 105.19 102.09 2o5j n GLY 61 Ca -0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 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 0.17 0.35 -5.26 1.61 1.79 -1.94 -3.41 116.57 109.88 2o5j h LYS 62 Ca 0.00 -0.05 -0.66 0.00 -2.18 0.00 0.00 60.65 57.76 2o5j h LYS 62 Cb 0.00 -0.06 -0.28 0.00 -1.58 0.00 0.00 32.23 30.31 2o5j h LYS 62 CO 0.00 0.36 -0.78 0.71 -1.08 0.00 0.00 179.45 178.66 2o5j s TYR 63 N -5.68 2.80 0.00 -1.35 1.51 -1.26 -5.04 117.35 108.33 2o5j s TYR 63 Ca -0.13 -0.81 0.00 0.00 -1.01 0.00 0.00 57.07 55.12 2o5j s TYR 63 Cb 0.08 -1.87 0.00 0.00 -0.11 0.00 0.00 41.96 40.06 2o5j s TYR 63 CO 0.71 -0.33 0.00 1.63 -1.11 0.00 0.00 175.55 176.46 2o5j n LYS 64 N 3.78 3.96 0.00 -0.62 4.01 -1.26 -3.35 118.16 124.68 2o5j n LYS 64 Ca -0.18 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.62 2o5j n LYS 64 Cb 0.52 -0.56 0.00 0.00 -0.51 0.00 0.00 35.03 34.48 2o5j n LYS 64 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 2o5j n ARG 65 N -0.90 3.92 0.02 1.97 3.00 -1.26 -3.59 116.66 119.82 2o5j n ARG 65 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.85 57.80 2o5j n ARG 65 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 32.46 32.35 2o5j n ARG 65 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 2o5j h GLN 66 N 0.00 0.00 -0.93 -0.14 -0.00 -1.98 -3.39 115.11 108.67 2o5j h GLN 66 Ca 0.00 0.00 0.27 0.00 -0.00 0.00 0.00 58.65 58.92 2o5j h GLN 66 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 27.48 27.33 2o5j h GLN 66 CO 0.00 0.58 0.35 -0.09 0.00 0.00 0.00 178.83 179.67 2o5j h ARG 67 N 0.00 0.23 -1.32 1.69 9.65 -2.01 0.11 114.38 122.73 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 1.81 -0.05 -0.37 0.00 -1.39 0.00 0.00 29.97 29.97 2o5j h ARG 67 CO 0.08 0.15 -0.06 1.97 2.80 0.00 0.00 179.97 184.91 2o5j n PHE 68 N -5.18 3.11 -0.17 2.20 1.16 -1.26 -4.84 117.46 112.49 2o5j n PHE 68 Ca 0.25 -2.69 0.12 0.00 -1.87 0.00 0.00 57.45 53.27 2o5j n PHE 68 Cb 0.80 -0.65 0.45 0.00 -1.61 0.00 0.00 39.48 38.47 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 2.46 0.51 -0.70 3.97 9.09 -0.96 -2.98 114.58 125.97 2o5j h GLU 69 Ca 0.44 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.81 2o5j h GLU 69 Cb 0.87 -0.12 0.00 0.00 -1.65 0.00 0.00 28.75 27.85 2o5j h GLU 69 CO 1.09 0.34 0.00 0.41 0.05 0.00 0.00 179.01 180.90 2o5j n GLY 70 N -1.49 2.56 3.75 1.06 0.00 -1.26 -3.82 105.19 105.99 2o5j n GLY 70 Ca 0.13 -0.77 -0.28 0.00 0.00 0.00 0.00 46.02 45.11 2o5j n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o5j s LYS 71 N -1.09 2.75 0.02 1.61 1.02 -1.13 -4.99 119.74 117.93 2o5j s LYS 71 Ca 0.47 -0.88 -0.02 0.00 0.02 0.00 0.00 55.97 55.57 2o5j s LYS 71 Cb 0.25 -2.59 -0.04 0.00 -0.52 0.00 0.00 37.83 34.93 2o5j s LYS 71 CO 0.31 0.50 0.20 0.54 -0.92 0.00 0.00 175.35 175.98 2o5j s VAL 72 N -1.61 5.41 0.19 3.17 0.11 -1.26 -4.54 120.40 121.87 2o5j s VAL 72 Ca 0.29 -0.24 -0.30 0.00 -2.93 0.00 0.00 61.98 58.80 2o5j s VAL 72 Cb -0.11 -3.58 -0.09 0.00 -1.53 0.00 0.00 36.38 31.08 2o5j s VAL 72 CO 0.21 0.25 1.39 0.00 -3.33 0.00 0.00 175.10 173.62 2o5j h GLU 74 N 5.68 0.06 0.09 0.00 4.81 -1.98 -3.23 114.58 120.00 2o5j h GLU 74 Ca -0.44 -0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 58.43 2o5j h GLU 74 Cb 1.21 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.55 2o5j h GLU 74 CO 0.80 0.04 -2.02 2.89 -0.73 0.00 0.00 179.01 179.99 2o5j n ARG 75 N -5.28 0.73 -5.20 1.92 1.85 -1.26 -4.92 116.66 104.50 2o5j n ARG 75 Ca 0.04 0.25 -0.30 0.00 -1.00 0.00 0.00 57.85 56.84 2o5j n ARG 75 Cb 0.26 -1.70 -0.16 0.00 -1.05 0.00 0.00 32.46 29.81 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 -0.41 1.30 -0.30 0.00 0.00 -1.26 -3.29 107.32 103.36 2o5j s GLY 77 Ca 0.05 -1.38 0.01 0.00 0.00 0.00 0.00 44.72 43.40 2o5j s GLY 77 CO 0.01 2.18 0.33 0.14 0.00 0.00 0.00 173.10 175.75 2o5j s VAL 78 N 4.32 -0.44 0.15 1.40 1.01 -1.26 -4.71 120.40 120.87 2o5j s VAL 78 Ca 0.30 -0.52 -0.20 0.00 0.00 0.00 0.00 61.98 61.57 2o5j s VAL 78 Cb -0.13 -0.95 -0.07 0.00 0.00 0.00 0.00 36.38 35.23 2o5j s VAL 78 CO 0.17 -0.45 0.65 -0.70 0.00 0.00 0.00 175.10 174.77 2o5j s GLU 79 N 2.27 4.26 0.00 2.72 -6.30 -1.26 -4.08 118.70 116.31 2o5j s GLU 79 Ca 0.10 0.83 -0.01 0.00 -2.50 0.00 0.00 54.97 53.39 2o5j s GLU 79 Cb -0.14 -3.10 -0.00 0.00 0.00 0.00 0.00 34.13 30.89 2o5j s GLU 79 CO -0.29 0.53 0.01 0.08 0.02 0.00 0.00 175.26 175.62 2o5j s VAL 80 N -1.29 0.04 0.00 3.70 1.01 -1.25 -4.68 120.40 117.93 2o5j s VAL 80 Ca 0.36 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.02 2o5j s VAL 80 Cb -0.19 -0.13 0.00 0.00 0.00 0.00 0.00 36.38 36.06 2o5j s VAL 80 CO 0.21 -0.17 0.00 0.41 0.00 0.00 0.00 175.10 175.55 2o5j n THR 81 N 2.53 0.00 -0.42 3.92 -1.04 -1.26 -4.78 114.28 113.23 2o5j n THR 81 Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 2o5j n THR 81 Cb 0.58 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.09 2o5j n THR 81 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2o5j n LYS 82 N 0.00 1.95 0.00 -2.82 5.02 -1.26 -4.11 118.16 116.95 2o5j n LYS 82 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 2o5j n LYS 82 Cb 0.00 0.00 0.33 0.00 -0.02 0.00 0.00 35.03 35.34 2o5j n LYS 82 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2o5j n SER 83 N 0.00 1.22 -0.25 4.39 7.64 -1.26 -4.10 113.62 121.27 2o5j n SER 83 Ca 0.00 -1.03 0.05 0.00 1.01 0.00 0.00 58.87 58.90 2o5j n SER 83 Cb 0.00 0.17 0.29 0.00 -1.01 0.00 0.00 64.21 63.67 2o5j n SER 83 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 2o5j h ILE 84 N 1.49 1.04 -1.06 0.44 3.07 -1.93 0.11 117.51 120.68 2o5j h ILE 84 Ca 0.00 -0.31 0.28 0.00 1.55 0.00 0.00 64.86 66.38 2o5j h ILE 84 Cb 0.55 0.06 -0.09 0.00 -0.27 0.00 0.00 36.82 37.06 2o5j h ILE 84 CO 0.00 0.16 0.68 -0.37 -1.05 0.00 0.00 178.15 177.58 2o5j h VAL 85 N 0.90 0.50 0.00 0.16 -1.51 -1.89 0.39 116.25 114.80 2o5j h VAL 85 Ca 0.36 -0.12 -0.05 0.00 -1.23 0.00 0.00 66.70 65.66 2o5j h VAL 85 Cb 0.25 0.11 -0.01 0.00 -2.13 0.00 0.00 31.29 29.52 2o5j h VAL 85 CO -0.13 0.07 -0.23 -0.09 -1.23 0.00 0.00 177.57 175.95 2o5j h ARG 86 N 0.36 0.00 -0.01 5.19 2.43 -0.80 -2.70 114.38 118.85 2o5j h ARG 86 Ca 0.60 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.77 2o5j h ARG 86 Cb 1.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.14 2o5j h ARG 86 CO -0.29 0.23 -0.52 2.89 -1.51 0.00 0.00 179.97 180.77 2o5j n ARG 87 N -4.01 0.85 -0.11 0.20 -4.01 0.13 -2.58 116.66 107.14 2o5j n ARG 87 Ca -0.02 -0.66 -0.20 0.00 -1.04 0.00 0.00 57.85 55.93 2o5j n ARG 87 Cb 0.31 -1.49 -0.12 0.00 -3.04 0.00 0.00 32.46 28.12 2o5j n ARG 87 CO 0.00 0.00 0.00 0.66 -3.04 0.00 0.00 177.63 175.25 2o5j n TYR 88 N -0.49 0.24 -1.83 2.89 0.53 -1.02 -4.35 117.16 113.12 2o5j n TYR 88 Ca 0.09 0.05 -0.37 0.00 -1.02 0.00 0.00 57.90 56.66 2o5j n TYR 88 Cb 0.41 -1.03 0.06 0.00 -1.03 0.00 0.00 39.34 37.75 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 -2.52 2.70 0.12 -0.72 3.00 -1.04 -4.65 118.95 115.84 2o5j s ARG 89 Ca -0.33 2.00 0.10 0.00 0.00 0.00 0.00 55.73 57.50 2o5j s ARG 89 Cb 0.09 -1.88 -0.04 0.00 0.00 0.00 0.00 34.95 33.12 2o5j s ARG 89 CO 0.62 -1.46 -0.24 -1.64 0.00 0.00 0.00 175.30 172.57 2o5j s MET 90 N -3.35 1.55 0.30 3.54 -1.94 -1.26 -2.18 119.30 115.96 2o5j s MET 90 Ca 0.81 -1.28 0.02 0.00 -1.71 0.00 0.00 55.69 53.53 2o5j s MET 90 Cb -0.35 -1.97 0.02 0.00 2.01 0.00 0.00 34.83 34.53 2o5j s MET 90 CO 0.38 0.46 0.16 0.41 -0.01 0.00 0.00 175.02 176.42 2o5j n GLY 91 N 0.93 3.16 3.25 -0.03 0.00 0.34 -1.29 105.19 111.55 2o5j n GLY 91 Ca -0.17 -2.26 -0.13 0.00 0.00 0.00 0.00 46.02 43.46 2o5j n GLY 91 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2o5j s HIS 92 N -1.67 -0.16 -0.21 1.61 -3.43 -1.21 0.52 115.29 110.74 2o5j s HIS 92 Ca 0.12 0.14 -0.01 0.00 -0.80 0.00 0.00 55.06 54.51 2o5j s HIS 92 Cb -0.01 0.11 0.01 0.00 -1.43 0.00 0.00 32.58 31.26 2o5j s HIS 92 CO 0.08 -0.46 -0.12 0.42 -2.00 0.00 0.00 174.74 172.66 2o5j s ILE 93 N -1.95 2.65 -0.56 -5.38 1.01 0.71 -3.09 121.20 114.59 2o5j s ILE 93 Ca -0.09 -0.83 -0.24 0.00 0.00 0.00 0.00 60.65 59.49 2o5j s ILE 93 Cb -0.03 -2.21 0.05 0.00 0.01 0.00 0.00 42.46 40.28 2o5j s ILE 93 CO 0.01 0.42 0.93 -0.70 0.00 0.00 0.00 174.94 175.60 2o5j s GLU 94 N 1.35 3.29 0.40 2.79 2.56 -1.26 0.90 118.70 128.73 2o5j s GLU 94 Ca 0.04 -0.37 -0.26 0.00 0.00 0.00 0.00 54.97 54.38 2o5j s GLU 94 Cb -0.14 -4.08 -0.09 0.00 2.00 0.00 0.00 34.13 31.82 2o5j s GLU 94 CO -0.08 -1.52 1.29 -0.51 -0.56 0.00 0.00 175.26 173.88 2o5j s LEU 95 N 3.92 4.23 0.00 2.70 1.02 -1.00 -5.00 118.68 124.54 2o5j s LEU 95 Ca 0.29 2.64 0.00 0.00 0.02 0.00 0.00 54.13 57.07 2o5j s LEU 95 Cb -0.13 -3.89 0.00 0.00 0.02 0.00 0.00 46.19 42.19 2o5j s LEU 95 CO 0.18 -0.82 0.25 0.00 0.02 0.00 0.00 176.35 175.98 2o5j n ALA 96 N 0.18 0.00 -2.77 4.21 0.00 -1.26 -4.74 120.51 116.13 2o5j n ALA 96 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.13 2o5j n ALA 96 Cb 0.44 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.80 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 -0.50 5.18 0.71 0.00 2.01 -1.26 -5.06 115.64 116.71 2o5j s THR 97 Ca 0.00 0.10 -0.17 0.00 0.31 0.00 0.00 61.69 61.93 2o5j s THR 97 Cb 0.00 -3.35 -0.11 0.00 0.01 0.00 0.00 72.50 69.06 2o5j s THR 97 CO 0.00 0.46 -0.05 -2.65 -0.69 0.00 0.00 174.62 171.68 2o5j n PRO 98 N 3.44 0.10 -4.20 4.92 -0.02 -1.26 -4.95 135.00 133.04 2o5j n PRO 98 Ca -0.16 0.05 -0.20 0.00 -2.02 0.00 0.00 63.50 61.17 2o5j n PRO 98 Cb 0.52 -1.31 -0.08 0.00 -0.02 0.00 0.00 33.50 32.62 2o5j n PRO 98 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2o5j n ALA 99 N -2.09 0.69 -2.16 3.55 0.00 -1.23 -3.68 120.51 115.59 2o5j n ALA 99 Ca 0.06 -1.92 -0.10 0.00 0.00 0.00 0.00 53.44 51.49 2o5j n ALA 99 Cb 0.50 1.52 -0.10 0.00 0.00 0.00 0.00 19.45 21.38 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 -3.30 0.89 0.09 0.00 0.00 -1.26 -3.09 121.76 115.08 2o5j s ALA 100 Ca 0.37 -1.37 -0.31 0.00 0.00 0.00 0.00 51.96 50.65 2o5j s ALA 100 Cb 0.02 0.38 -0.09 0.00 0.00 0.00 0.00 23.12 23.43 2o5j s ALA 100 CO 0.26 -0.33 1.73 -1.58 0.00 0.00 0.00 175.76 175.84 2o5j s HIS 101 N -3.79 2.27 -0.25 0.00 2.46 -1.26 -4.82 115.29 109.90 2o5j s HIS 101 Ca 0.15 0.16 0.28 0.00 0.47 0.00 0.00 55.06 56.12 2o5j s HIS 101 Cb 0.07 -4.05 0.97 0.00 -0.13 0.00 0.00 32.58 29.44 2o5j s HIS 101 CO -0.04 -4.29 1.81 0.97 -2.47 0.00 0.00 174.74 170.72 2o5j h ILE 102 N 4.81 0.00 -0.60 0.89 2.10 -1.93 -2.83 117.51 119.95 2o5j h ILE 102 Ca -0.44 -0.57 0.03 0.00 1.08 0.00 0.00 64.86 64.96 2o5j h ILE 102 Cb 1.21 1.51 -0.03 0.00 -1.09 0.00 0.00 36.82 38.42 2o5j h ILE 102 CO 0.94 0.00 0.40 -0.50 -1.08 0.00 0.00 178.15 177.90 2o5j h TRP 103 N 0.00 0.68 0.00 2.19 4.06 -1.97 -0.28 115.95 120.63 2o5j h TRP 103 Ca 0.00 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.97 2o5j h TRP 103 Cb 0.63 -0.23 0.00 0.00 -1.00 0.00 0.00 29.16 28.56 2o5j h TRP 103 CO 0.00 0.40 -1.01 1.19 -3.56 0.00 0.00 178.44 175.46 2o5j n PHE 104 N -4.46 0.00 -0.09 0.49 0.99 -1.12 -3.89 117.46 109.38 2o5j n PHE 104 Ca 0.07 0.00 -0.19 0.00 -0.00 0.00 0.00 57.45 57.33 2o5j n PHE 104 Cb 0.13 -0.03 -0.13 0.00 -1.00 0.00 0.00 39.48 38.45 2o5j n PHE 104 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 2o5j n VAL 105 N -1.52 1.57 -0.06 -4.37 0.31 -0.98 -2.65 118.33 110.62 2o5j n VAL 105 Ca 0.03 -0.60 0.08 0.00 -0.01 0.00 0.00 64.34 63.84 2o5j n VAL 105 Cb 0.33 -1.48 0.19 0.00 -0.91 0.00 0.00 33.84 31.97 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 -3.31 2.48 -1.98 5.55 4.76 -0.15 -4.68 118.16 120.84 2o5j n LYS 106 Ca -0.42 -2.12 -0.36 0.00 -2.87 0.00 0.00 58.31 52.55 2o5j n LYS 106 Cb 1.01 -1.37 0.04 0.00 -1.84 0.00 0.00 35.03 32.87 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 -1.07 5.14 0.13 4.39 -1.08 -1.25 -4.90 116.67 118.03 2o5j s ASP 107 Ca 0.30 2.38 -0.27 0.00 -0.52 0.00 0.00 52.55 54.44 2o5j s ASP 107 Cb 0.16 -2.60 -0.06 0.00 -1.46 0.00 0.00 42.92 38.96 2o5j s ASP 107 CO 0.22 -1.63 1.46 0.58 0.52 0.00 0.00 175.17 176.33 2o5j h VAL 108 N 0.80 0.00 -3.19 1.11 2.07 -1.94 -3.08 116.25 112.02 2o5j h VAL 108 Ca -0.50 0.00 -0.60 0.00 0.82 0.00 0.00 66.70 66.42 2o5j h VAL 108 Cb 1.30 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.95 2o5j h VAL 108 CO 0.55 0.00 0.62 -2.16 0.02 0.00 0.00 177.57 176.60 2o5j s PRO 109 N -5.16 3.35 -0.63 1.57 0.05 -1.26 -4.92 135.00 128.00 2o5j s PRO 109 Ca -0.11 -0.20 -0.27 0.00 0.05 0.00 0.00 61.00 60.48 2o5j s PRO 109 Cb 0.09 -4.05 -0.11 0.00 0.05 0.00 0.00 34.50 30.48 2o5j s PRO 109 CO 0.53 -1.52 2.47 0.45 0.05 0.00 0.00 177.00 178.98 2o5j n SER 110 N 7.60 1.80 0.09 6.66 2.88 -1.16 -4.72 113.62 126.76 2o5j n SER 110 Ca 0.03 -0.48 0.20 0.00 -1.33 0.00 0.00 58.87 57.29 2o5j n SER 110 Cb 0.48 -1.45 0.71 0.00 -0.75 0.00 0.00 64.21 63.20 2o5j n SER 110 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2o5j h LYS 111 N 17.39 0.00 0.02 -1.46 1.63 -1.79 1.03 116.57 133.40 2o5j h LYS 111 Ca -0.17 0.00 -0.34 0.00 -0.85 0.00 0.00 60.65 59.29 2o5j h LYS 111 Cb 1.25 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.83 2o5j h LYS 111 CO 1.20 0.00 -2.05 1.51 -3.45 0.00 0.00 179.45 176.66 2o5j n ILE 112 N -3.54 1.57 0.18 2.00 0.13 -1.22 -3.34 119.36 115.14 2o5j n ILE 112 Ca 0.08 -0.76 0.06 0.00 -1.10 0.00 0.00 62.75 61.03 2o5j n ILE 112 Cb 0.69 -1.06 0.20 0.00 -0.84 0.00 0.00 39.64 38.63 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 2.99 0.00 0.00 4.50 0.00 -0.29 -1.76 103.07 108.50 2o5j h GLY 113 Ca -0.42 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.90 2o5j h GLY 113 CO 0.05 0.00 -0.06 -0.84 0.00 0.00 0.00 176.54 175.69 2o5j h THR 114 N 0.00 1.38 0.45 4.70 2.02 0.65 -3.29 112.91 118.83 2o5j h THR 114 Ca -0.00 -2.06 -0.02 0.00 0.77 0.00 0.00 66.41 65.10 2o5j h THR 114 Cb 1.10 2.63 0.00 0.00 -1.74 0.00 0.00 68.15 70.15 2o5j h THR 114 CO 0.04 0.47 -0.22 0.25 0.37 0.00 0.00 175.52 176.44 2o5j h LEU 115 N -1.00 -0.51 -8.83 2.58 6.46 -1.65 -3.38 115.31 108.98 2o5j h LEU 115 Ca -0.01 -0.02 -0.61 0.00 -0.12 0.00 0.00 57.88 57.12 2o5j h LEU 115 Cb 0.81 0.13 -0.11 0.00 -0.73 0.00 0.00 40.66 40.76 2o5j h LEU 115 CO -0.01 -0.31 0.40 -0.22 -0.62 0.00 0.00 178.44 177.68 2o5j s LEU 116 N -9.98 4.11 -0.86 2.25 0.20 -0.66 -4.95 118.68 108.78 2o5j s LEU 116 Ca -0.16 0.44 -0.25 0.00 0.69 0.00 0.00 54.13 54.86 2o5j s LEU 116 Cb 0.04 -3.06 -0.05 0.00 -0.43 0.00 0.00 46.19 42.68 2o5j s LEU 116 CO 0.61 -0.72 1.99 -0.62 -0.29 0.00 0.00 176.35 177.32 2o5j s ASP 117 N 1.80 5.03 0.28 3.68 2.15 -1.26 -4.34 116.67 124.01 2o5j s ASP 117 Ca 0.32 -0.51 0.02 0.00 0.43 0.00 0.00 52.55 52.82 2o5j s ASP 117 Cb -0.13 -2.56 -0.06 0.00 -0.30 0.00 0.00 42.92 39.88 2o5j s ASP 117 CO 0.16 -2.82 0.07 -0.76 -0.17 0.00 0.00 175.17 171.65 2o5j s LEU 118 N 10.44 1.90 -0.47 -1.34 1.43 -1.24 -5.03 118.68 124.37 2o5j s LEU 118 Ca 0.72 -1.36 -0.27 0.00 -1.03 0.00 0.00 54.13 52.19 2o5j s LEU 118 Cb -0.08 -0.16 -0.05 0.00 0.03 0.00 0.00 46.19 45.93 2o5j s LEU 118 CO 0.02 -0.66 2.24 -0.44 0.23 0.00 0.00 176.35 177.74 2o5j s SER 119 N -3.38 4.82 0.09 2.29 0.01 -1.26 -4.74 113.70 111.53 2o5j s SER 119 Ca 0.36 1.04 0.05 0.00 1.31 0.00 0.00 55.95 58.71 2o5j s SER 119 Cb 0.08 -2.51 0.32 0.00 0.21 0.00 0.00 66.02 64.12 2o5j s SER 119 CO 0.14 -2.59 0.40 0.00 0.41 0.00 0.00 173.24 171.59 2o5j n ALA 120 N 14.40 0.24 0.00 1.44 0.00 -1.26 -1.81 120.51 133.53 2o5j n ALA 120 Ca 0.32 0.26 0.00 0.00 0.00 0.00 0.00 53.44 54.02 2o5j n ALA 120 Cb 0.53 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.73 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 -3.64 0.00 -0.10 0.00 -2.24 -1.26 -4.40 114.28 102.64 2o5j n THR 121 Ca 0.09 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.63 2o5j n THR 121 Cb 0.31 -0.50 -0.12 0.00 -2.10 0.00 0.00 70.33 67.92 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 -1.33 0.62 -0.26 -0.78 4.07 -0.88 -3.43 120.64 118.66 2o5j n GLU 122 Ca 0.00 0.35 0.12 0.00 -0.06 0.00 0.00 57.16 57.57 2o5j n GLU 122 Cb 0.26 -1.62 0.39 0.00 -0.06 0.00 0.00 31.44 30.41 2o5j n GLU 122 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2o5j h LEU 123 N -0.63 0.63 0.57 4.31 4.07 -1.71 0.10 115.31 122.66 2o5j h LEU 123 Ca -0.51 0.04 -0.03 0.00 0.08 0.00 0.00 57.88 57.46 2o5j h LEU 123 Cb 1.64 -0.08 0.01 0.00 1.08 0.00 0.00 40.66 43.30 2o5j h LEU 123 CO -0.20 0.31 -0.28 -0.33 -1.08 0.00 0.00 178.44 176.87 2o5j h GLU 124 N 0.66 -0.74 -0.21 1.13 3.07 -1.71 -2.46 114.58 114.32 2o5j h GLU 124 Ca 0.45 0.05 0.06 0.00 -0.50 0.00 0.00 59.36 59.42 2o5j h GLU 124 Cb 0.75 0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.82 2o5j h GLU 124 CO -0.20 -0.49 0.29 0.37 -1.40 0.00 0.00 179.01 177.57 2o5j h GLN 125 N -0.81 0.00 0.44 2.33 5.75 -1.48 -0.32 115.11 121.02 2o5j h GLN 125 Ca -0.08 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.40 2o5j h GLN 125 Cb 0.59 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.14 2o5j h GLN 125 CO 0.13 0.00 -0.21 0.28 -2.65 0.00 0.00 178.83 176.38 2o5j h VAL 126 N 0.00 0.00 0.11 2.39 2.07 -0.35 -3.31 116.25 117.16 2o5j h VAL 126 Ca 0.10 -0.02 -0.27 0.00 0.82 0.00 0.00 66.70 67.33 2o5j h VAL 126 Cb 0.68 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2o5j h VAL 126 CO -0.00 0.00 -1.19 0.17 0.02 0.00 0.00 177.57 176.57 2o5j h LEU 127 N -0.61 0.52 -0.05 2.57 8.10 -1.17 -3.18 115.31 121.50 2o5j h LEU 127 Ca -0.06 -0.51 0.01 0.00 0.11 0.00 0.00 57.88 57.43 2o5j h LEU 127 Cb 0.45 -0.17 -0.03 0.00 -0.44 0.00 0.00 40.66 40.48 2o5j h LEU 127 CO 0.10 1.37 -0.21 1.88 -4.11 0.00 0.00 178.44 177.47 2o5j h TYR 128 N 0.13 -0.63 0.07 0.17 0.99 -1.19 -3.07 116.97 113.43 2o5j h TYR 128 Ca -0.14 0.02 -0.27 0.00 2.00 0.00 0.00 58.73 60.35 2o5j h TYR 128 Cb 1.88 0.28 -0.02 0.00 1.00 0.00 0.00 36.73 39.88 2o5j h TYR 128 CO 0.07 -0.21 -1.31 0.74 -0.00 0.00 0.00 178.16 177.45 2o5j h PHE 129 N -0.23 0.27 -1.20 4.88 0.05 -1.76 -3.44 116.94 115.52 2o5j h PHE 129 Ca 0.01 -0.20 0.00 0.00 3.82 0.00 0.00 57.97 61.61 2o5j h PHE 129 Cb 0.26 -0.01 0.00 0.00 2.00 0.00 0.00 35.95 38.20 2o5j h PHE 129 CO -0.50 1.19 0.00 0.45 -0.18 0.00 0.00 178.31 179.27 2o5j n SER 130 N -3.39 0.00 -3.85 2.17 2.88 -1.16 -4.78 113.62 105.48 2o5j n SER 130 Ca -0.09 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.11 2o5j n SER 130 Cb 1.01 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 64.41 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 0.00 2.94 -4.55 -1.46 0.00 -1.26 -4.72 118.16 109.12 2o5j n LYS 131 Ca 0.00 -4.56 -0.27 0.00 0.00 0.00 0.00 58.31 53.48 2o5j n LYS 131 Cb 0.00 -2.38 -0.08 0.00 0.00 0.00 0.00 35.03 32.58 2o5j n LYS 131 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 2o5j s TYR 132 N -2.05 1.78 0.06 5.64 1.51 -1.26 -4.44 117.35 118.59 2o5j s TYR 132 Ca 0.32 -1.30 -0.06 0.00 -1.01 0.00 0.00 57.07 55.01 2o5j s TYR 132 Cb 0.03 -1.19 -0.01 0.00 -0.11 0.00 0.00 41.96 40.68 2o5j s TYR 132 CO -0.04 -0.29 0.12 0.42 -1.11 0.00 0.00 175.55 174.64 2o5j s ILE 133 N -3.15 0.15 -0.04 2.71 1.01 -0.66 -4.08 121.20 117.14 2o5j s ILE 133 Ca 0.20 -1.21 0.01 0.00 0.00 0.00 0.00 60.65 59.66 2o5j s ILE 133 Cb 0.02 -1.15 0.02 0.00 0.01 0.00 0.00 42.46 41.36 2o5j s ILE 133 CO 0.14 -0.67 -0.04 0.68 0.00 0.00 0.00 174.94 175.05 2o5j s VAL 134 N -3.24 0.51 -0.26 2.92 -7.23 -1.09 -0.20 120.40 111.82 2o5j s VAL 134 Ca 0.00 -0.13 -0.28 0.00 -1.81 0.00 0.00 61.98 59.76 2o5j s VAL 134 Cb 0.02 -0.52 0.01 0.00 0.56 0.00 0.00 36.38 36.45 2o5j s VAL 134 CO -0.08 0.21 1.00 -0.22 -0.31 0.00 0.00 175.10 175.70 2o5j s LEU 135 N 0.77 4.06 0.00 1.32 0.20 -1.01 -1.88 118.68 122.14 2o5j s LEU 135 Ca -0.10 1.20 0.00 0.00 0.69 0.00 0.00 54.13 55.92 2o5j s LEU 135 Cb -0.13 -3.45 0.00 0.00 -0.43 0.00 0.00 46.19 42.17 2o5j s LEU 135 CO 0.00 -0.69 0.17 -0.67 -0.29 0.00 0.00 176.35 174.87 2o5j n ASP 136 N 6.39 0.00 0.00 3.68 4.64 -0.71 -4.01 116.55 126.54 2o5j n ASP 136 Ca 0.10 0.23 0.00 0.00 -1.38 0.00 0.00 54.79 53.74 2o5j n ASP 136 Cb 0.47 -0.09 0.00 0.00 -1.04 0.00 0.00 41.12 40.46 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 -0.77 0.00 -4.20 -0.67 -0.02 -1.26 -4.80 135.00 123.27 2o5j n PRO 137 Ca 0.00 0.07 -0.16 0.00 -2.02 0.00 0.00 63.50 61.39 2o5j n PRO 137 Cb 0.00 -0.41 -0.13 0.00 -0.02 0.00 0.00 33.50 32.94 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 -0.57 0.65 -0.47 -0.52 0.00 -1.26 -4.82 119.74 112.75 2o5j s LYS 138 Ca 0.00 -0.59 0.06 0.00 0.00 0.00 0.00 55.97 55.44 2o5j s LYS 138 Cb 0.00 -0.57 0.22 0.00 0.00 0.00 0.00 37.83 37.48 2o5j s LYS 138 CO 0.00 0.14 0.72 0.41 0.00 0.00 0.00 175.35 176.62 2o5j n GLY 139 N 2.07 0.57 0.27 0.59 0.00 -1.24 -3.20 105.19 104.26 2o5j n GLY 139 Ca -0.18 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 45.60 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 2.09 -0.15 -1.53 4.61 0.00 -1.24 -4.18 120.51 120.11 2o5j n ALA 140 Ca 0.16 0.68 -0.38 0.00 0.00 0.00 0.00 53.44 53.90 2o5j n ALA 140 Cb 0.58 -0.27 0.05 0.00 0.00 0.00 0.00 19.45 19.81 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 -5.00 3.09 -3.11 0.00 -0.00 -1.26 -4.26 119.36 108.82 2o5j n ILE 141 Ca 0.06 -0.49 -0.18 0.00 -0.00 0.00 0.00 62.75 62.15 2o5j n ILE 141 Cb 0.26 -0.95 0.00 0.00 -0.00 0.00 0.00 39.64 38.95 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 -1.06 3.67 -0.03 1.39 1.43 -1.26 -4.21 118.68 118.62 2o5j s LEU 142 Ca 0.73 -0.42 0.04 0.00 -1.03 0.00 0.00 54.13 53.45 2o5j s LEU 142 Cb -0.41 -2.62 -0.06 0.00 0.03 0.00 0.00 46.19 43.13 2o5j s LEU 142 CO 0.50 -0.71 0.04 -0.46 0.23 0.00 0.00 176.35 175.94 2o5j n ASN 143 N -1.80 4.01 0.00 2.29 6.94 -1.26 -4.91 115.26 120.52 2o5j n ASN 143 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.63 2o5j n ASN 143 Cb 0.59 0.79 0.00 0.00 -2.36 0.00 0.00 39.78 38.80 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 2.60 0.36 3.39 4.83 0.00 -1.26 -5.13 105.19 109.98 2o5j n GLY 144 Ca -0.05 0.00 -0.20 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 1.94 1.11 1.61 0.11 -1.26 -5.16 120.40 118.75 2o5j s VAL 145 Ca 0.00 -2.26 -0.17 0.00 -2.93 0.00 0.00 61.98 56.62 2o5j s VAL 145 Cb 0.00 -2.15 0.16 0.00 -1.53 0.00 0.00 36.38 32.86 2o5j s VAL 145 CO 0.00 -0.52 0.23 -0.81 -3.33 0.00 0.00 175.10 170.67 2o5j n PRO 146 N -0.47 -2.26 -1.68 1.54 -0.04 -1.26 -4.52 135.00 126.31 2o5j n PRO 146 Ca -0.07 -0.66 -0.46 0.00 -0.04 0.00 0.00 63.50 62.27 2o5j n PRO 146 Cb 0.60 -1.62 -0.04 0.00 -0.04 0.00 0.00 33.50 32.40 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 -4.58 0.30 -2.68 0.52 3.14 -1.26 -4.75 118.33 109.03 2o5j n VAL 147 Ca 0.04 -0.05 -0.43 0.00 -2.96 0.00 0.00 64.34 60.94 2o5j n VAL 147 Cb 0.50 -1.83 -0.03 0.00 -1.06 0.00 0.00 33.84 31.42 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 2.51 3.71 0.24 1.45 8.01 -1.26 -4.91 118.70 128.44 2o5j s GLU 148 Ca 0.84 0.50 -0.05 0.00 0.01 0.00 0.00 54.97 56.28 2o5j s GLU 148 Cb -0.62 -3.89 0.43 0.00 -4.31 0.00 0.00 34.13 25.74 2o5j s GLU 148 CO 0.42 -1.26 1.72 1.57 0.01 0.00 0.00 175.26 177.72 2o5j h LYS 149 N 9.02 0.40 0.00 1.61 5.09 -1.88 -3.32 116.57 127.49 2o5j h LYS 149 Ca -0.23 -0.02 0.00 0.00 0.09 0.00 0.00 60.65 60.49 2o5j h LYS 149 Cb 1.07 -0.09 0.00 0.00 0.10 0.00 0.00 32.23 33.31 2o5j h LYS 149 CO 1.08 0.26 0.00 -2.13 -2.09 0.00 0.00 179.45 176.58 2o5j n ARG 150 N -5.02 1.57 -0.98 0.07 0.63 -1.26 -4.42 116.66 107.26 2o5j n ARG 150 Ca 0.13 -0.05 -0.29 0.00 -0.92 0.00 0.00 57.85 56.73 2o5j n ARG 150 Cb 0.40 -0.32 0.21 0.00 0.45 0.00 0.00 32.46 33.20 2o5j n ARG 150 CO 0.00 0.00 0.00 -1.14 -2.51 0.00 0.00 177.63 173.98 2o5j s GLN 151 N -0.24 -0.33 0.08 -0.14 2.00 -1.25 -4.56 119.66 115.22 2o5j s GLN 151 Ca 0.00 0.46 0.10 0.00 -2.00 0.00 0.00 55.36 53.92 2o5j s GLN 151 Cb 0.00 -1.65 -0.03 0.00 0.80 0.00 0.00 33.01 32.12 2o5j s GLN 151 CO 0.00 -3.23 -0.26 -0.48 -0.50 0.00 0.00 175.29 170.82 2o5j s LEU 152 N -6.78 2.23 0.30 3.68 2.34 -1.26 -2.40 118.68 116.79 2o5j s LEU 152 Ca 0.67 -0.65 0.03 0.00 0.06 0.00 0.00 54.13 54.24 2o5j s LEU 152 Cb -0.19 -1.24 -0.06 0.00 -0.56 0.00 0.00 46.19 44.15 2o5j s LEU 152 CO 0.59 0.22 0.07 -1.48 -1.06 0.00 0.00 176.35 174.70 2o5j s LEU 153 N -1.56 1.97 0.32 1.48 0.05 0.71 -4.95 118.68 116.72 2o5j s LEU 153 Ca 0.12 -1.38 0.00 0.00 0.05 0.00 0.00 54.13 52.92 2o5j s LEU 153 Cb -0.10 -0.22 -0.04 0.00 -2.05 0.00 0.00 46.19 43.78 2o5j s LEU 153 CO 0.04 -0.66 0.53 0.28 -0.55 0.00 0.00 176.35 175.98 2o5j s THR 154 N -3.47 5.11 0.43 5.48 -1.32 -1.26 -1.65 115.64 118.96 2o5j s THR 154 Ca 0.37 -0.43 0.09 0.00 -1.21 0.00 0.00 61.69 60.51 2o5j s THR 154 Cb 0.08 -3.84 0.28 0.00 -1.51 0.00 0.00 72.50 67.51 2o5j s THR 154 CO 0.15 -0.49 2.05 -0.78 -2.21 0.00 0.00 174.62 173.33 2o5j h ASP 155 N 0.96 0.41 0.79 8.08 3.58 -1.96 -0.38 116.42 127.89 2o5j h ASP 155 Ca -0.49 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 56.91 2o5j h ASP 155 Cb 1.21 -0.10 0.01 0.00 1.72 0.00 0.00 39.33 42.18 2o5j h ASP 155 CO 0.62 0.28 -0.38 -0.33 -2.88 0.00 0.00 179.24 176.56 2o5j h GLU 156 N 0.47 -1.02 0.00 0.28 4.39 -1.95 1.54 114.58 118.29 2o5j h GLU 156 Ca 0.16 0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.93 2o5j h GLU 156 Cb 0.07 0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2o5j h GLU 156 CO -0.04 -0.68 0.00 0.93 -1.16 0.00 0.00 179.01 178.06 2o5j h GLU 157 N -1.06 0.00 0.04 2.33 3.07 -1.95 -2.22 114.58 114.79 2o5j h GLU 157 Ca -0.11 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.50 2o5j h GLU 157 Cb 0.81 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.69 2o5j h GLU 157 CO 0.18 0.00 -1.32 -0.92 -1.40 0.00 0.00 179.01 175.55 2o5j h TYR 158 N 0.00 0.14 -0.14 4.33 3.20 -0.69 -3.26 116.97 120.55 2o5j h TYR 158 Ca 0.00 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 61.75 2o5j h TYR 158 Cb 0.54 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.80 2o5j h TYR 158 CO 0.00 1.11 0.00 0.07 -1.64 0.00 0.00 178.16 177.70 2o5j h ARG 159 N 0.02 0.25 -1.00 1.82 0.11 0.28 -3.22 114.38 112.65 2o5j h ARG 159 Ca -0.14 -0.08 0.09 0.00 0.10 0.00 0.00 59.98 59.95 2o5j h ARG 159 Cb 1.90 -0.02 -0.08 0.00 1.11 0.00 0.00 29.97 32.88 2o5j h ARG 159 CO 0.13 0.48 0.64 0.93 0.10 0.00 0.00 179.97 182.25 2o5j h GLU 160 N -0.01 1.05 -0.01 0.08 5.08 -1.53 -3.17 114.58 116.07 2o5j h GLU 160 Ca 0.04 -0.06 -0.22 0.00 -1.00 0.00 0.00 59.36 58.12 2o5j h GLU 160 Cb 0.36 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 2o5j h GLU 160 CO 0.01 0.69 -0.91 1.25 -1.00 0.00 0.00 179.01 179.05 2o5j h LEU 161 N 1.08 0.47 0.18 1.33 6.46 -1.60 -3.34 115.31 119.89 2o5j h LEU 161 Ca 0.46 -0.37 -0.01 0.00 -0.12 0.00 0.00 57.88 57.84 2o5j h LEU 161 Cb 0.33 -0.14 0.00 0.00 -0.73 0.00 0.00 40.66 40.12 2o5j h LEU 161 CO -0.21 1.17 -0.08 -0.09 -0.62 0.00 0.00 178.44 178.60 2o5j h ARG 162 N 0.21 -0.23 -0.18 1.25 2.43 -1.55 -3.11 114.38 113.19 2o5j h ARG 162 Ca -0.07 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.17 2o5j h ARG 162 Cb 1.54 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 31.13 2o5j h ARG 162 CO 0.15 0.14 0.31 0.10 -1.51 0.00 0.00 179.97 179.16 2o5j h TYR 163 N -0.95 0.00 0.00 2.20 -0.00 -1.77 -3.39 116.97 113.07 2o5j h TYR 163 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.71 2o5j h TYR 163 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.20 2o5j h TYR 163 CO 0.07 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.64 2o5j n GLY 164 N -1.35 0.00 0.03 0.10 0.00 -1.18 -3.70 105.19 99.10 2o5j n GLY 164 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 2o5j n GLY 164 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o5j h LYS 165 N 0.00 0.00 -6.50 1.61 6.56 -1.84 -3.43 116.57 112.97 2o5j h LYS 165 Ca 0.00 0.00 -0.55 0.00 -1.06 0.00 0.00 60.65 59.04 2o5j h LYS 165 Cb 0.00 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 31.59 2o5j h LYS 165 CO 0.00 0.00 1.04 -1.14 -2.06 0.00 0.00 179.45 177.29 2o5j s GLN 166 N -1.55 3.42 -0.06 3.15 -0.44 -1.24 -4.29 119.66 118.65 2o5j s GLN 166 Ca -0.06 0.37 0.03 0.00 -2.50 0.00 0.00 55.36 53.20 2o5j s GLN 166 Cb 0.01 -4.06 0.00 0.00 -1.64 0.00 0.00 33.01 27.32 2o5j s GLN 166 CO 0.09 -1.79 -0.17 -1.21 0.50 0.00 0.00 175.29 172.72 2o5j s GLU 167 N 5.20 2.00 -0.08 1.67 2.02 -1.19 -4.86 118.70 123.45 2o5j s GLU 167 Ca 0.48 -0.58 -0.13 0.00 0.02 0.00 0.00 54.97 54.76 2o5j s GLU 167 Cb -0.09 -1.64 -0.05 0.00 0.10 0.00 0.00 34.13 32.45 2o5j s GLU 167 CO 0.25 0.15 0.31 0.99 0.02 0.00 0.00 175.26 176.98 2o5j s THR 168 N 0.34 5.23 -0.23 3.63 2.01 -1.26 -1.52 115.64 123.84 2o5j s THR 168 Ca -0.11 0.61 0.02 0.00 0.31 0.00 0.00 61.69 62.51 2o5j s THR 168 Cb -0.14 -3.62 0.05 0.00 0.01 0.00 0.00 72.50 68.80 2o5j s THR 168 CO 0.04 0.52 -0.10 -0.31 -0.69 0.00 0.00 174.62 174.08 2o5j s TYR 169 N -0.53 2.85 0.42 4.92 1.51 -0.38 -4.98 117.35 121.14 2o5j s TYR 169 Ca 0.20 -1.98 -0.24 0.00 -1.01 0.00 0.00 57.07 54.04 2o5j s TYR 169 Cb -0.14 -1.79 -0.08 0.00 -0.11 0.00 0.00 41.96 39.83 2o5j s TYR 169 CO 0.08 -0.82 1.12 -2.14 -1.11 0.00 0.00 175.55 172.68 2o5j s PRO 170 N 1.25 4.00 -0.17 -1.71 0.02 -1.26 -0.50 135.00 136.62 2o5j s PRO 170 Ca -0.05 1.68 0.01 0.00 0.02 0.00 0.00 61.00 62.66 2o5j s PRO 170 Cb -0.18 -2.53 0.02 0.00 0.02 0.00 0.00 34.50 31.83 2o5j s PRO 170 CO -0.07 -0.32 -0.20 -0.51 -0.33 0.00 0.00 177.00 175.57 2o5j s LEU 171 N -2.74 2.14 0.33 -5.54 1.43 -0.19 -4.86 118.68 109.25 2o5j s LEU 171 Ca 0.60 -0.63 -0.27 0.00 -1.03 0.00 0.00 54.13 52.80 2o5j s LEU 171 Cb -0.26 -1.47 -0.13 0.00 0.03 0.00 0.00 46.19 44.35 2o5j s LEU 171 CO 0.33 0.03 0.93 -0.81 0.23 0.00 0.00 176.35 177.05 2o5j n PRO 172 N 4.44 1.19 -1.65 1.29 -0.04 -1.26 -4.71 135.00 134.26 2o5j n PRO 172 Ca -0.21 0.42 -0.41 0.00 -0.04 0.00 0.00 63.50 63.26 2o5j n PRO 172 Cb 0.51 -1.80 0.01 0.00 -0.04 0.00 0.00 33.50 32.17 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 0.60 1.64 -0.73 0.54 -0.04 -1.26 -1.87 135.00 133.88 2o5j n PRO 173 Ca 0.10 0.58 0.00 0.00 -0.04 0.00 0.00 63.50 64.15 2o5j n PRO 173 Cb 0.34 -2.19 0.00 0.00 -0.04 0.00 0.00 33.50 31.61 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 1.00 1.49 3.75 0.55 0.00 -1.26 -5.02 105.19 105.70 2o5j n GLY 174 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.71 5.39 0.21 1.61 1.01 -0.78 -5.09 120.40 119.04 2o5j s VAL 175 Ca 0.00 0.28 -0.09 0.00 0.00 0.00 0.00 61.98 62.17 2o5j s VAL 175 Cb 0.00 -3.50 -0.07 0.00 0.00 0.00 0.00 36.38 32.81 2o5j s VAL 175 CO 0.00 0.45 0.52 1.51 0.00 0.00 0.00 175.10 177.58 2o5j s ASP 176 N 0.23 6.62 0.61 3.32 -4.77 -1.26 -4.86 116.67 116.55 2o5j s ASP 176 Ca 0.11 0.88 -0.04 0.00 -3.30 0.00 0.00 52.55 50.21 2o5j s ASP 176 Cb -0.12 -2.21 0.03 0.00 -1.09 0.00 0.00 42.92 39.54 2o5j s ASP 176 CO 0.00 -0.04 0.88 0.00 0.70 0.00 0.00 175.17 176.71 2o5j s ALA 177 N -1.77 3.46 -0.21 2.11 0.00 -1.26 -4.47 121.76 119.62 2o5j s ALA 177 Ca 0.46 -0.99 0.15 0.00 0.00 0.00 0.00 51.96 51.58 2o5j s ALA 177 Cb -0.12 -2.41 0.60 0.00 0.00 0.00 0.00 23.12 21.19 2o5j s ALA 177 CO 0.21 -0.92 1.51 1.28 0.00 0.00 0.00 175.76 177.84 2o5j n LEU 178 N -2.59 4.38 -4.00 0.00 7.99 -1.15 -4.92 117.00 116.71 2o5j n LEU 178 Ca 0.06 -3.07 -0.09 0.00 -0.01 0.00 0.00 56.01 52.90 2o5j n LEU 178 Cb 0.59 -0.59 -0.11 0.00 -0.11 0.00 0.00 43.42 43.20 2o5j n LEU 178 CO 0.50 0.71 -0.36 -0.69 -1.51 0.00 0.00 177.39 176.04 2o5j s VAL 179 N -2.87 0.14 0.44 4.08 1.01 -1.26 -4.94 120.40 117.00 2o5j s VAL 179 Ca 0.45 -1.11 -0.05 0.00 0.00 0.00 0.00 61.98 61.27 2o5j s VAL 179 Cb 0.37 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 2o5j s VAL 179 CO 0.10 -0.61 0.74 -1.59 0.00 0.00 0.00 175.10 173.74 2o5j s LYS 180 N -2.01 3.58 0.21 2.72 0.00 -1.26 -4.95 119.74 118.03 2o5j s LYS 180 Ca -0.11 0.17 0.11 0.00 0.00 0.00 0.00 55.97 56.14 2o5j s LYS 180 Cb -0.06 -2.43 0.74 0.00 0.00 0.00 0.00 37.83 36.08 2o5j s LYS 180 CO -0.03 -0.11 0.91 -3.47 0.00 0.00 0.00 175.35 172.65 2o5j n ASP 181 N -1.96 0.17 -2.20 0.03 4.64 -1.26 -1.05 116.55 114.92 2o5j n ASP 181 Ca 0.00 0.96 0.02 0.00 -1.38 0.00 0.00 54.79 54.39 2o5j n ASP 181 Cb 0.55 -0.45 0.04 0.00 -1.04 0.00 0.00 41.12 40.21 2o5j n ASP 181 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2o5j n GLY 182 N -1.17 1.41 3.79 0.27 0.00 -1.10 -3.04 105.19 105.36 2o5j n GLY 182 Ca 0.21 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.94 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 -1.98 3.71 -0.11 1.61 2.12 -0.21 -4.70 118.70 119.13 2o5j s GLU 183 Ca 0.30 1.38 -0.29 0.00 0.36 0.00 0.00 54.97 56.72 2o5j s GLU 183 Cb 0.35 -2.08 -0.03 0.00 0.26 0.00 0.00 34.13 32.63 2o5j s GLU 183 CO -0.10 -0.51 1.37 -1.21 -0.54 0.00 0.00 175.26 174.27 2o5j s GLU 184 N -3.29 4.23 -0.05 4.30 2.02 -1.26 -1.66 118.70 123.00 2o5j s GLU 184 Ca 0.68 1.83 0.05 0.00 0.02 0.00 0.00 54.97 57.54 2o5j s GLU 184 Cb -0.17 -3.79 -0.02 0.00 0.10 0.00 0.00 34.13 30.25 2o5j s GLU 184 CO 0.22 -0.71 -0.19 0.08 0.02 0.00 0.00 175.26 174.67 2o5j s VAL 185 N 3.45 2.63 0.25 2.63 1.01 -0.15 -4.95 120.40 125.28 2o5j s VAL 185 Ca 0.60 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.79 2o5j s VAL 185 Cb -0.26 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 2o5j s VAL 185 CO 0.20 0.58 0.08 -0.69 0.00 0.00 0.00 175.10 175.27 2o5j s VAL 186 N -0.52 3.88 -0.08 2.92 1.01 -1.26 -1.23 120.40 125.11 2o5j s VAL 186 Ca 0.07 -1.66 -0.33 0.00 0.00 0.00 0.00 61.98 60.06 2o5j s VAL 186 Cb -0.11 -3.07 -0.10 0.00 0.00 0.00 0.00 36.38 33.09 2o5j s VAL 186 CO 0.01 -0.34 1.96 1.17 0.00 0.00 0.00 175.10 177.90 2o5j n LYS 187 N -0.94 2.28 0.00 2.72 4.81 -1.26 -1.59 118.16 124.18 2o5j n LYS 187 Ca -0.07 0.81 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 2o5j n LYS 187 Cb 0.58 -2.79 0.00 0.00 0.02 0.00 0.00 35.03 32.85 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 4.70 0.10 3.77 3.14 0.00 -0.02 -4.94 105.19 111.93 2o5j n GLY 188 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.95 4.47 -0.36 1.61 0.74 -0.62 -4.66 119.66 119.88 2o5j s GLN 189 Ca 0.00 1.62 -0.29 0.00 0.05 0.00 0.00 55.36 56.75 2o5j s GLN 189 Cb 0.00 -2.92 0.01 0.00 1.10 0.00 0.00 33.01 31.20 2o5j s GLN 189 CO 0.00 0.11 1.34 -1.21 -0.55 0.00 0.00 175.29 174.98 2o5j s GLU 190 N -1.87 3.75 0.00 1.67 2.02 -1.26 -0.66 118.70 122.35 2o5j s GLU 190 Ca 0.50 1.06 0.29 0.00 0.02 0.00 0.00 54.97 56.84 2o5j s GLU 190 Cb -0.27 -3.95 1.21 0.00 0.10 0.00 0.00 34.13 31.22 2o5j s GLU 190 CO 0.34 -1.33 1.84 1.28 0.02 0.00 0.00 175.26 177.40 2o5j n LEU 191 N 8.16 0.62 0.00 1.80 4.77 -1.07 -4.56 117.00 126.72 2o5j n LEU 191 Ca 0.15 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2o5j n LEU 191 Cb 0.47 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2o5j n LEU 191 CO 0.67 0.11 0.00 0.00 -1.33 0.00 0.00 177.39 176.84 2o5j n ALA 192 N -0.79 0.00 -0.30 -1.18 0.00 -1.20 -2.95 120.51 114.09 2o5j n ALA 192 Ca 0.16 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.71 2o5j n ALA 192 Cb 0.28 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.98 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 0.10 0.01 0.00 0.13 -1.92 -2.82 132.00 127.51 2o5j h PRO 193 Ca 0.00 -0.01 -0.34 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 31.05 2o5j h PRO 193 CO 0.00 0.07 -2.08 0.41 -0.23 0.00 0.00 178.00 176.16 2o5j n GLY 194 N -1.43 -0.95 3.80 1.56 0.00 -1.26 -4.96 105.19 101.95 2o5j n GLY 194 Ca 0.20 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.54 4.42 -0.05 1.61 1.01 -1.06 -5.06 120.40 118.73 2o5j s VAL 195 Ca -0.10 1.50 -0.02 0.00 0.00 0.00 0.00 61.98 63.37 2o5j s VAL 195 Cb 0.07 -3.90 0.03 0.00 0.00 0.00 0.00 36.38 32.59 2o5j s VAL 195 CO 0.81 0.14 0.09 -0.69 0.00 0.00 0.00 175.10 175.45 2o5j s VAL 196 N -1.61 -0.07 0.49 2.92 1.01 -1.26 -2.60 120.40 119.27 2o5j s VAL 196 Ca 0.47 0.22 -0.22 0.00 0.00 0.00 0.00 61.98 62.45 2o5j s VAL 196 Cb -0.17 -0.17 -0.06 0.00 0.00 0.00 0.00 36.38 35.98 2o5j s VAL 196 CO 0.21 0.09 1.22 -0.44 0.00 0.00 0.00 175.10 176.19 2o5j s SER 197 N 1.26 5.85 0.00 3.32 0.01 0.17 -4.91 113.70 119.41 2o5j s SER 197 Ca -0.07 2.43 0.09 0.00 1.31 0.00 0.00 55.95 59.70 2o5j s SER 197 Cb -0.12 -2.61 0.06 0.00 0.21 0.00 0.00 66.02 63.55 2o5j s SER 197 CO -0.04 -1.14 0.74 -1.14 0.41 0.00 0.00 173.24 172.06 2o5j n ARG 198 N -0.72 0.53 -3.63 12.44 0.63 -1.26 -0.84 116.66 123.80 2o5j n ARG 198 Ca 0.09 -0.94 -0.13 0.00 -0.92 0.00 0.00 57.85 55.95 2o5j n ARG 198 Cb 0.47 -1.14 -0.06 0.00 0.45 0.00 0.00 32.46 32.18 2o5j n ARG 198 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2o5j s LEU 199 N -0.85 0.24 0.55 6.15 1.02 -1.26 -4.79 118.68 119.74 2o5j s LEU 199 Ca 0.10 -0.00 -0.19 0.00 0.02 0.00 0.00 54.13 54.06 2o5j s LEU 199 Cb 0.07 1.89 -0.05 0.00 0.02 0.00 0.00 46.19 48.11 2o5j s LEU 199 CO 0.12 -0.72 1.10 -1.81 0.02 0.00 0.00 176.35 175.07 2o5j s ASP 200 N -2.15 5.77 0.00 2.29 1.01 -1.26 -3.98 116.67 118.35 2o5j s ASP 200 Ca -0.04 2.07 0.00 0.00 0.71 0.00 0.00 52.55 55.29 2o5j s ASP 200 Cb -0.00 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.36 2o5j s ASP 200 CO -0.04 -1.18 0.00 0.61 0.21 0.00 0.00 175.17 174.77 2o5j n GLY 201 N -0.13 0.09 3.37 0.21 0.00 -0.37 -4.68 105.19 103.68 2o5j n GLY 201 Ca 0.11 -1.43 -0.33 0.00 0.00 0.00 0.00 46.02 44.37 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 -2.99 2.97 -0.30 1.61 1.01 -1.05 -0.98 120.40 120.67 2o5j s VAL 202 Ca 0.00 -0.70 -0.28 0.00 0.00 0.00 0.00 61.98 61.00 2o5j s VAL 202 Cb 0.00 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 34.16 2o5j s VAL 202 CO 0.00 0.53 1.03 0.00 0.00 0.00 0.00 175.10 176.67 2o5j s ALA 203 N 0.24 3.54 -0.04 5.51 0.00 -0.66 -1.41 121.76 128.93 2o5j s ALA 203 Ca -0.09 -0.06 0.02 0.00 0.00 0.00 0.00 51.96 51.83 2o5j s ALA 203 Cb -0.16 -3.60 -0.03 0.00 0.00 0.00 0.00 23.12 19.33 2o5j s ALA 203 CO 0.05 -1.37 -0.08 -0.51 0.00 0.00 0.00 175.76 173.85 2o5j s LEU 204 N 3.48 3.08 -0.02 0.00 1.43 -1.13 -2.73 118.68 122.80 2o5j s LEU 204 Ca 0.43 -0.10 -0.19 0.00 -1.03 0.00 0.00 54.13 53.25 2o5j s LEU 204 Cb -0.13 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.34 2o5j s LEU 204 CO 0.13 0.33 0.53 -0.31 0.23 0.00 0.00 176.35 177.27 2o5j s TYR 205 N -0.85 3.67 -0.42 0.29 1.51 -1.17 -1.00 117.35 119.38 2o5j s TYR 205 Ca 0.14 1.10 -0.09 0.00 -1.01 0.00 0.00 57.07 57.20 2o5j s TYR 205 Cb -0.11 -2.53 0.08 0.00 -0.11 0.00 0.00 41.96 39.29 2o5j s TYR 205 CO 0.03 0.39 0.26 1.03 -1.11 0.00 0.00 175.55 176.15 2o5j s ARG 206 N -0.27 2.62 0.00 -0.62 1.81 -0.33 -4.93 118.95 117.23 2o5j s ARG 206 Ca 0.28 -1.44 0.00 0.00 -1.72 0.00 0.00 55.73 52.85 2o5j s ARG 206 Cb -0.17 -3.79 0.00 0.00 -0.45 0.00 0.00 34.95 30.54 2o5j s ARG 206 CO 0.15 -0.95 0.00 1.19 -0.68 0.00 0.00 175.30 175.01 2o5j n PHE 207 N 4.93 0.00 0.00 -0.53 3.01 -1.26 -3.44 117.46 120.16 2o5j n PHE 207 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.36 2o5j n PHE 207 Cb 0.43 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.90 2o5j n PHE 207 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 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 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 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 -0.25 -0.54 -0.26 0.00 1.04 -1.22 -1.02 113.70 111.44 2o5j s SER 392 Ca 0.00 0.56 -0.03 0.00 0.48 0.00 0.00 55.95 56.96 2o5j s SER 392 Cb 0.00 0.45 0.02 0.00 0.10 0.00 0.00 66.02 66.59 2o5j s SER 392 CO 0.00 -0.53 -0.02 -0.63 0.98 0.00 0.00 173.24 173.05 2o5j s ILE 393 N -1.31 3.23 -0.73 -1.02 1.01 0.34 -1.19 121.20 121.53 2o5j s ILE 393 Ca -0.07 -0.90 -0.19 0.00 0.00 0.00 0.00 60.65 59.49 2o5j s ILE 393 Cb -0.00 -2.64 0.11 0.00 0.01 0.00 0.00 42.46 39.94 2o5j s ILE 393 CO 0.06 0.17 0.90 -1.48 0.00 0.00 0.00 174.94 174.58 2o5j s LEU 394 N 1.38 5.18 -0.93 2.97 2.34 -0.17 -1.25 118.68 128.20 2o5j s LEU 394 Ca 0.01 -1.62 -0.26 0.00 0.06 0.00 0.00 54.13 52.32 2o5j s LEU 394 Cb -0.17 -2.35 -0.17 0.00 -0.56 0.00 0.00 46.19 42.94 2o5j s LEU 394 CO -0.02 -1.13 2.26 -0.69 -1.06 0.00 0.00 176.35 175.71 2o5j s VAL 395 N 2.79 3.04 -0.36 1.48 1.01 -0.58 -2.83 120.40 124.95 2o5j s VAL 395 Ca 0.21 -0.05 -0.20 0.00 0.00 0.00 0.00 61.98 61.94 2o5j s VAL 395 Cb -0.16 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.73 2o5j s VAL 395 CO 0.01 -0.08 0.61 -0.69 0.00 0.00 0.00 175.10 174.95 2o5j s VAL 396 N 15.59 4.91 -0.35 2.92 1.01 -0.50 -3.15 120.40 140.83 2o5j s VAL 396 Ca 0.87 0.48 -0.10 0.00 0.00 0.00 0.00 61.98 63.22 2o5j s VAL 396 Cb -0.09 -4.07 -0.10 0.00 0.00 0.00 0.00 36.38 32.12 2o5j s VAL 396 CO 0.12 -0.33 1.53 1.17 0.00 0.00 0.00 175.10 177.60 2o5j n LYS 397 N 6.01 0.77 -4.20 2.72 4.81 -1.26 -2.52 118.16 124.49 2o5j n LYS 397 Ca -0.02 -1.03 -0.16 0.00 -0.87 0.00 0.00 58.31 56.23 2o5j n LYS 397 Cb 0.49 -2.34 -0.14 0.00 0.02 0.00 0.00 35.03 33.06 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 4.93 0.58 -0.27 3.14 0.00 -1.25 -2.50 121.76 126.38 2o5j s ALA 398 Ca 0.31 -0.41 -0.10 0.00 0.00 0.00 0.00 51.96 51.76 2o5j s ALA 398 Cb 0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 2o5j s ALA 398 CO 0.07 0.11 0.15 1.03 0.00 0.00 0.00 175.76 177.12 2o5j s ARG 399 N -0.50 3.82 -0.98 0.00 0.52 -1.25 -3.98 118.95 116.59 2o5j s ARG 399 Ca -0.00 -0.39 -0.23 0.00 -0.52 0.00 0.00 55.73 54.58 2o5j s ARG 399 Cb -0.04 -3.56 0.01 0.00 0.52 0.00 0.00 34.95 31.88 2o5j s ARG 399 CO -0.00 -0.20 1.64 0.54 0.02 0.00 0.00 175.30 177.30 2o5j s VAL 400 N 1.71 3.74 -0.52 3.52 0.11 -1.26 -3.88 120.40 123.82 2o5j s VAL 400 Ca 0.07 -0.63 -0.25 0.00 -2.93 0.00 0.00 61.98 58.23 2o5j s VAL 400 Cb -0.16 -4.67 0.03 0.00 -1.53 0.00 0.00 36.38 30.06 2o5j s VAL 400 CO 0.09 -1.56 0.98 -0.31 -3.33 0.00 0.00 175.10 170.96 2o5j s TYR 401 N 6.91 2.81 0.47 1.54 1.51 -0.85 -4.88 117.35 124.87 2o5j s TYR 401 Ca 0.55 0.21 -0.22 0.00 -1.01 0.00 0.00 57.07 56.60 2o5j s TYR 401 Cb -0.02 -4.11 -0.07 0.00 -0.11 0.00 0.00 41.96 37.64 2o5j s TYR 401 CO -0.06 -1.30 1.12 -2.14 -1.11 0.00 0.00 175.55 172.07 2o5j s PRO 402 N 4.04 3.74 -0.01 -1.71 0.02 -1.26 -2.12 135.00 137.70 2o5j s PRO 402 Ca 0.35 1.64 0.01 0.00 0.02 0.00 0.00 61.00 63.03 2o5j s PRO 402 Cb -0.11 -2.30 0.00 0.00 0.02 0.00 0.00 34.50 32.12 2o5j s PRO 402 CO 0.23 -0.54 -0.04 -0.59 -0.33 0.00 0.00 177.00 175.73 2o5j s PHE 403 N -1.67 0.43 -0.18 6.54 -0.12 -1.22 -4.94 117.98 116.82 2o5j s PHE 403 Ca 0.65 -0.08 0.15 0.00 -0.05 0.00 0.00 56.93 57.61 2o5j s PHE 403 Cb -0.25 -0.33 -0.24 0.00 -0.63 0.00 0.00 43.02 41.57 2o5j s PHE 403 CO 0.30 -0.05 0.15 0.39 -0.05 0.00 0.00 175.22 175.96 2o5j n GLU 404 N 3.27 0.68 -4.00 1.99 1.02 -1.26 -4.78 120.64 117.57 2o5j n GLU 404 Ca -0.16 0.06 -0.22 0.00 -0.02 0.00 0.00 57.16 56.81 2o5j n GLU 404 Cb 0.56 -1.57 -0.03 0.00 -0.02 0.00 0.00 31.44 30.39 2o5j n GLU 404 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2o5j s ASP 405 N -5.70 6.15 0.91 1.62 1.01 -1.26 -5.09 116.67 114.32 2o5j s ASP 405 Ca -0.11 0.03 -0.15 0.00 0.71 0.00 0.00 52.55 53.02 2o5j s ASP 405 Cb 0.07 -1.77 -0.07 0.00 1.01 0.00 0.00 42.92 42.15 2o5j s ASP 405 CO 0.81 -0.03 -0.17 -0.90 0.21 0.00 0.00 175.17 175.09 2o5j n ASP 406 N -1.16 -3.89 -4.85 0.27 5.68 -1.26 -3.88 116.55 107.46 2o5j n ASP 406 Ca -0.08 0.32 -0.34 0.00 -0.50 0.00 0.00 54.79 54.18 2o5j n ASP 406 Cb 0.56 -0.98 -0.06 0.00 -1.14 0.00 0.00 41.12 39.51 2o5j n ASP 406 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2o5j s VAL 407 N -2.13 4.88 -0.08 2.12 1.01 -1.26 -1.92 120.40 123.01 2o5j s VAL 407 Ca 0.50 0.72 0.19 0.00 0.00 0.00 0.00 61.98 63.40 2o5j s VAL 407 Cb -0.23 -3.70 -0.29 0.00 0.00 0.00 0.00 36.38 32.16 2o5j s VAL 407 CO 0.73 0.14 0.45 1.21 0.00 0.00 0.00 175.10 177.63 2o5j n GLU 408 N 0.50 0.60 -3.63 2.72 2.13 0.29 -4.93 120.64 118.31 2o5j n GLU 408 Ca -0.03 -0.16 -0.29 0.00 0.66 0.00 0.00 57.16 57.33 2o5j n GLU 408 Cb 0.52 -1.45 -0.04 0.00 0.27 0.00 0.00 31.44 30.74 2o5j n GLU 408 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2o5j s VAL 409 N -3.30 5.16 0.08 6.31 1.01 -1.11 -5.03 120.40 123.53 2o5j s VAL 409 Ca -0.06 -0.17 0.09 0.00 0.00 0.00 0.00 61.98 61.84 2o5j s VAL 409 Cb 0.12 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2o5j s VAL 409 CO 0.80 -0.13 -0.22 -0.94 0.00 0.00 0.00 175.10 174.60 2o5j s SER 410 N -2.93 3.53 -0.09 3.32 1.04 -1.26 -4.92 113.70 112.39 2o5j s SER 410 Ca 0.40 -0.58 -0.33 0.00 0.48 0.00 0.00 55.95 55.92 2o5j s SER 410 Cb -0.11 -0.41 -0.11 0.00 0.10 0.00 0.00 66.02 65.49 2o5j s SER 410 CO 0.28 0.22 1.94 0.41 0.98 0.00 0.00 173.24 177.07 2o5j n THR 411 N 1.29 0.59 0.00 2.02 -1.04 -1.26 -2.11 114.28 113.77 2o5j n THR 411 Ca -0.17 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 2o5j n THR 411 Cb 0.52 -2.01 0.00 0.00 -1.82 0.00 0.00 70.33 67.03 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 4.65 1.18 3.73 3.41 0.00 0.77 -4.97 105.19 113.96 2o5j n GLY 412 Ca 0.24 -0.27 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.66 4.48 0.17 1.61 3.68 -0.90 -4.51 116.67 120.55 2o5j s ASP 413 Ca 0.00 2.48 -0.09 0.00 2.13 0.00 0.00 52.55 57.07 2o5j s ASP 413 Cb 0.00 -2.60 -0.07 0.00 -1.45 0.00 0.00 42.92 38.80 2o5j s ASP 413 CO 0.00 -2.08 0.48 -0.13 0.13 0.00 0.00 175.17 173.58 2o5j s ARG 414 N -3.60 3.78 0.16 4.34 3.00 -1.26 -1.81 118.95 123.55 2o5j s ARG 414 Ca 0.78 0.21 0.04 0.00 0.00 0.00 0.00 55.73 56.76 2o5j s ARG 414 Cb -0.33 -2.79 -0.05 0.00 0.00 0.00 0.00 34.95 31.78 2o5j s ARG 414 CO 0.41 0.42 -0.08 0.08 0.00 0.00 0.00 175.30 176.13 2o5j s VAL 415 N -1.66 1.11 0.21 3.52 1.01 0.19 -4.95 120.40 119.84 2o5j s VAL 415 Ca 0.42 -2.05 0.02 0.00 0.00 0.00 0.00 61.98 60.38 2o5j s VAL 415 Cb -0.12 -1.94 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 2o5j s VAL 415 CO 0.21 -0.67 0.02 0.00 0.00 0.00 0.00 175.10 174.66 2o5j s ALA 416 N -3.37 1.62 -0.29 5.51 0.00 -1.26 -1.82 121.76 122.15 2o5j s ALA 416 Ca 0.19 -1.72 -0.28 0.00 0.00 0.00 0.00 51.96 50.15 2o5j s ALA 416 Cb 0.03 0.60 -0.05 0.00 0.00 0.00 0.00 23.12 23.71 2o5j s ALA 416 CO 0.02 -0.31 2.20 -2.14 0.00 0.00 0.00 175.76 175.53 2o5j s PRO 417 N -3.91 2.94 0.00 0.00 0.02 -1.26 -2.53 135.00 130.25 2o5j s PRO 417 Ca 0.28 1.80 0.00 0.00 0.02 0.00 0.00 61.00 63.11 2o5j s PRO 417 Cb 0.06 -4.40 0.00 0.00 0.02 0.00 0.00 34.50 30.19 2o5j s PRO 417 CO 0.08 -2.33 0.00 0.41 -0.33 0.00 0.00 177.00 174.83 2o5j n GLY 418 N 5.77 3.57 3.58 0.52 0.00 -0.41 -5.00 105.19 113.22 2o5j n GLY 418 Ca 0.30 -0.99 -0.53 0.00 0.00 0.00 0.00 46.02 44.80 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 1.37 -4.76 1.61 9.92 -1.05 -4.39 116.55 119.25 2o5j n ASP 419 Ca 0.00 1.13 -0.39 0.00 -0.53 0.00 0.00 54.79 54.99 2o5j n ASP 419 Cb 0.00 -1.14 0.02 0.00 -0.64 0.00 0.00 41.12 39.36 2o5j n ASP 419 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2o5j s VAL 420 N 0.48 2.09 0.00 2.53 1.01 -1.26 -1.45 120.40 123.79 2o5j s VAL 420 Ca 0.86 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.92 2o5j s VAL 420 Cb -1.01 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 32.32 2o5j s VAL 420 CO 0.49 0.01 0.00 0.18 0.00 0.00 0.00 175.10 175.78 2o5j n LEU 421 N -0.46 2.73 -3.84 3.92 4.77 0.27 -4.67 117.00 119.72 2o5j n LEU 421 Ca 0.07 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.03 2o5j n LEU 421 Cb 0.43 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.53 2o5j n LEU 421 CO 0.57 0.45 0.89 0.00 -1.33 0.00 0.00 177.39 177.97 2o5j s ALA 422 N -1.92 -1.86 -1.49 -1.18 0.00 -1.09 -0.55 121.76 113.67 2o5j s ALA 422 Ca 0.00 -0.03 -0.12 0.00 0.00 0.00 0.00 51.96 51.81 2o5j s ALA 422 Cb 0.00 0.70 0.07 0.00 0.00 0.00 0.00 23.12 23.89 2o5j s ALA 422 CO 0.00 -1.07 1.01 -0.25 0.00 0.00 0.00 175.76 175.45 2o5j n ASP 423 N -0.94 -4.89 0.00 0.00 8.00 -0.81 -2.33 116.55 115.58 2o5j n ASP 423 Ca -0.03 -0.73 0.00 0.00 0.71 0.00 0.00 54.79 54.73 2o5j n ASP 423 Cb 0.60 -4.13 0.00 0.00 -0.02 0.00 0.00 41.12 37.58 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 -1.75 0.54 0.02 0.44 0.00 -1.26 -2.75 105.19 100.43 2o5j n GLY 424 Ca 0.01 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.95 0.09 -0.02 0.00 -1.26 -4.08 105.19 98.97 2o5j n GLY 425 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 2o5j n GLY 425 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o5j h LYS 426 N 0.07 -0.11 -4.92 1.61 1.57 -1.67 -3.41 116.57 109.71 2o5j h LYS 426 Ca 0.00 0.01 -0.69 0.00 -1.87 0.00 0.00 60.65 58.10 2o5j h LYS 426 Cb 0.02 0.02 -0.18 0.00 0.08 0.00 0.00 32.23 32.17 2o5j h LYS 426 CO 0.00 0.30 0.07 0.08 -0.57 0.00 0.00 179.45 179.33 2o5j s VAL 427 N -4.40 4.86 0.20 0.50 1.01 -0.98 -5.05 120.40 116.54 2o5j s VAL 427 Ca -0.15 -0.58 0.11 0.00 0.00 0.00 0.00 61.98 61.36 2o5j s VAL 427 Cb 0.02 -4.34 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 2o5j s VAL 427 CO 0.62 -0.87 -0.21 -0.54 0.00 0.00 0.00 175.10 174.11 2o5j s LYS 428 N 2.66 1.64 0.51 2.72 1.02 -1.26 0.93 119.74 127.96 2o5j s LYS 428 Ca 0.15 -1.51 -0.12 0.00 0.02 0.00 0.00 55.97 54.51 2o5j s LYS 428 Cb -0.20 -1.89 -0.06 0.00 -0.52 0.00 0.00 37.83 35.16 2o5j s LYS 428 CO 0.11 0.40 0.92 0.45 -0.92 0.00 0.00 175.35 176.31 2o5j s SER 429 N -2.80 6.44 0.00 2.83 0.15 -0.53 -4.89 113.70 114.90 2o5j s SER 429 Ca 0.23 1.33 0.06 0.00 0.70 0.00 0.00 55.95 58.27 2o5j s SER 429 Cb -0.08 -2.42 -0.07 0.00 -1.71 0.00 0.00 66.02 61.75 2o5j s SER 429 CO 0.11 -0.62 0.27 0.47 1.20 0.00 0.00 173.24 174.67 2o5j n ASP 430 N -1.95 0.32 -4.16 5.45 10.43 -1.26 -1.29 116.55 124.09 2o5j n ASP 430 Ca 0.05 -0.66 -0.10 0.00 2.57 0.00 0.00 54.79 56.64 2o5j n ASP 430 Cb 0.54 0.98 -0.10 0.00 1.84 0.00 0.00 41.12 44.38 2o5j n ASP 430 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2o5j s VAL 431 N -1.57 0.41 0.37 2.53 1.01 -1.26 -4.52 120.40 117.37 2o5j s VAL 431 Ca 0.02 -1.91 -0.20 0.00 0.00 0.00 0.00 61.98 59.90 2o5j s VAL 431 Cb 0.05 -1.86 -0.10 0.00 0.00 0.00 0.00 36.38 34.47 2o5j s VAL 431 CO 0.25 -0.68 0.87 -0.31 0.00 0.00 0.00 175.10 175.23 2o5j s TYR 432 N -3.82 3.40 -5.00 5.22 1.51 -1.26 -4.12 117.35 113.28 2o5j s TYR 432 Ca 0.17 1.50 0.00 0.00 -1.01 0.00 0.00 57.07 57.74 2o5j s TYR 432 Cb 0.07 -2.75 0.00 0.00 -0.11 0.00 0.00 41.96 39.16 2o5j s TYR 432 CO -0.02 0.02 0.00 0.41 -1.11 0.00 0.00 175.55 174.85 2o5j n GLY 433 N -0.31 -0.50 3.80 0.71 0.00 -0.76 -3.85 105.19 104.28 2o5j n GLY 433 Ca 0.05 -1.67 -0.31 0.00 0.00 0.00 0.00 46.02 44.09 2o5j n GLY 433 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2o5j s ARG 434 N -1.55 2.55 0.02 1.61 3.52 -1.26 -0.64 118.95 123.20 2o5j s ARG 434 Ca 0.00 0.96 0.08 0.00 -0.13 0.00 0.00 55.73 56.64 2o5j s ARG 434 Cb 0.00 -1.95 -0.03 0.00 -1.56 0.00 0.00 34.95 31.42 2o5j s ARG 434 CO 0.00 -1.38 -0.25 0.08 -0.81 0.00 0.00 175.30 172.94 2o5j s VAL 435 N -3.02 2.21 -0.26 7.11 1.01 -0.75 -1.52 120.40 125.19 2o5j s VAL 435 Ca 0.59 -1.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 2o5j s VAL 435 Cb -0.15 -1.84 0.09 0.00 0.00 0.00 0.00 36.38 34.48 2o5j s VAL 435 CO 0.55 0.44 0.09 -1.61 0.00 0.00 0.00 175.10 174.57 2o5j s GLU 436 N -1.04 0.46 -0.99 2.72 8.01 -0.84 -0.16 118.70 126.86 2o5j s GLU 436 Ca 0.11 -0.63 -0.18 0.00 0.01 0.00 0.00 54.97 54.28 2o5j s GLU 436 Cb -0.10 -1.73 0.13 0.00 -4.31 0.00 0.00 34.13 28.11 2o5j s GLU 436 CO 0.01 -0.88 1.22 0.08 0.01 0.00 0.00 175.26 175.71 2o5j s VAL 437 N 1.89 4.69 -0.33 2.63 1.01 -1.26 -2.84 120.40 126.18 2o5j s VAL 437 Ca 0.06 -1.68 -0.29 0.00 0.00 0.00 0.00 61.98 60.07 2o5j s VAL 437 Cb -0.17 -4.84 0.01 0.00 0.00 0.00 0.00 36.38 31.39 2o5j s VAL 437 CO -0.23 -1.58 1.17 -1.81 0.00 0.00 0.00 175.10 172.65 2o5j s ASP 438 N 3.64 6.80 -0.15 3.32 -0.00 -0.94 -4.87 116.67 124.47 2o5j s ASP 438 Ca 0.36 1.04 0.17 0.00 -0.00 0.00 0.00 52.55 54.12 2o5j s ASP 438 Cb -0.04 -2.54 0.76 0.00 -0.00 0.00 0.00 42.92 41.10 2o5j s ASP 438 CO -0.08 -1.00 1.68 0.18 -0.00 0.00 0.00 175.17 175.95 2o5j n LEU 439 N 7.27 5.11 -0.02 1.23 4.77 -1.26 -1.51 117.00 132.60 2o5j n LEU 439 Ca 0.13 -2.61 0.07 0.00 -0.03 0.00 0.00 56.01 53.57 2o5j n LEU 439 Cb 0.47 -0.62 -0.15 0.00 -2.33 0.00 0.00 43.42 40.79 2o5j n LEU 439 CO 0.62 0.76 -0.76 0.52 -1.33 0.00 0.00 177.39 177.20 2o5j n VAL 440 N 0.96 0.34 -0.27 4.08 0.31 -1.26 -4.31 118.33 118.19 2o5j n VAL 440 Ca 0.27 -0.58 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 2o5j n VAL 440 Cb 1.00 -0.13 0.00 0.00 -0.91 0.00 0.00 33.84 33.79 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 -2.40 2.00 -3.93 5.55 1.74 -1.26 -5.02 116.66 113.34 2o5j n ARG 441 Ca -0.09 -1.17 -0.28 0.00 -0.77 0.00 0.00 57.85 55.54 2o5j n ARG 441 Cb 0.68 -0.87 -0.01 0.00 -1.02 0.00 0.00 32.46 31.25 2o5j n ARG 441 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2o5j n ASN 442 N -0.34 -1.24 -4.01 0.55 3.02 -1.18 -4.97 115.26 107.08 2o5j n ASN 442 Ca 0.00 -1.04 -0.08 0.00 -0.03 0.00 0.00 54.58 53.43 2o5j n ASN 442 Cb 0.30 -2.96 -0.09 0.00 -0.61 0.00 0.00 39.78 36.42 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 -3.88 0.18 -0.27 2.41 0.11 -0.57 -3.41 120.40 114.98 2o5j s VAL 443 Ca 0.10 -1.60 0.01 0.00 -2.93 0.00 0.00 61.98 57.57 2o5j s VAL 443 Cb -0.04 -1.51 0.08 0.00 -1.53 0.00 0.00 36.38 33.38 2o5j s VAL 443 CO 0.89 -0.83 -0.01 -0.69 -3.33 0.00 0.00 175.10 171.13 2o5j s VAL 444 N -3.91 1.66 0.10 2.04 1.01 -0.90 -2.21 120.40 118.19 2o5j s VAL 444 Ca 0.08 -1.54 -0.15 0.00 0.00 0.00 0.00 61.98 60.36 2o5j s VAL 444 Cb 0.07 -2.03 -0.07 0.00 0.00 0.00 0.00 36.38 34.36 2o5j s VAL 444 CO -0.09 -0.29 0.52 0.00 0.00 0.00 0.00 175.10 175.23 2o5j s ARG 445 N 1.29 4.00 -0.35 2.72 1.70 -1.13 -2.00 118.95 125.18 2o5j s ARG 445 Ca 0.00 0.51 0.01 0.00 -0.47 0.00 0.00 55.73 55.78 2o5j s ARG 445 Cb -0.19 -3.07 0.11 0.00 -0.57 0.00 0.00 34.95 31.23 2o5j s ARG 445 CO -0.09 0.57 0.11 0.08 -1.08 0.00 0.00 175.30 174.89 2o5j s VAL 446 N -1.30 1.47 0.00 4.99 1.01 -1.25 -1.99 120.40 123.34 2o5j s VAL 446 Ca 0.33 -1.97 0.00 0.00 0.00 0.00 0.00 61.98 60.33 2o5j s VAL 446 Cb -0.16 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.13 2o5j s VAL 446 CO 0.18 -0.70 0.00 1.33 0.00 0.00 0.00 175.10 175.91 2o5j n VAL 447 N 4.37 0.00 -4.10 2.92 0.24 -0.58 -3.75 118.33 117.43 2o5j n VAL 447 Ca 0.02 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.18 2o5j n VAL 447 Cb 0.40 0.00 -0.13 0.00 -1.47 0.00 0.00 33.84 32.65 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 -1.04 0.48 -0.28 7.34 -6.30 -1.04 -4.32 118.70 113.53 2o5j s GLU 448 Ca 0.00 -0.51 -0.17 0.00 -2.50 0.00 0.00 54.97 51.79 2o5j s GLU 448 Cb 0.00 -0.33 0.09 0.00 0.00 0.00 0.00 34.13 33.89 2o5j s GLU 448 CO 0.00 0.07 0.76 -1.54 0.02 0.00 0.00 175.26 174.57 2o5j s SER 449 N -0.97 -0.83 -0.31 -1.70 1.04 -1.25 -4.34 113.70 105.33 2o5j s SER 449 Ca -0.05 1.35 -0.02 0.00 0.48 0.00 0.00 55.95 57.71 2o5j s SER 449 Cb -0.07 1.34 0.11 0.00 0.10 0.00 0.00 66.02 67.51 2o5j s SER 449 CO 0.00 -0.21 0.14 -0.31 0.98 0.00 0.00 173.24 173.84 2o5j s TYR 450 N 1.48 0.85 0.04 5.02 4.12 -1.26 -4.75 117.35 122.86 2o5j s TYR 450 Ca -0.09 -1.32 -0.38 0.00 0.02 0.00 0.00 57.07 55.30 2o5j s TYR 450 Cb -0.05 -1.18 -0.19 0.00 -1.52 0.00 0.00 41.96 39.02 2o5j s TYR 450 CO -0.18 -0.84 1.09 -0.25 0.02 0.00 0.00 175.55 175.40 2o5j n ASP 451 N 4.84 0.29 -3.72 2.29 8.00 -1.26 -4.51 116.55 122.48 2o5j n ASP 451 Ca -0.01 1.15 -0.30 0.00 0.71 0.00 0.00 54.79 56.34 2o5j n ASP 451 Cb 0.41 -0.99 -0.15 0.00 -0.02 0.00 0.00 41.12 40.37 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 0.02 0.84 -0.35 0.53 2.07 -1.26 -3.60 121.20 119.45 2o5j s ILE 452 Ca 0.87 -1.40 -0.29 0.00 -1.41 0.00 0.00 60.65 58.43 2o5j s ILE 452 Cb -1.17 -1.64 -0.00 0.00 0.13 0.00 0.00 42.46 39.78 2o5j s ILE 452 CO 0.55 -0.69 1.46 -1.81 -1.91 0.00 0.00 174.94 172.55 2o5j s ASP 453 N 1.61 6.37 -0.03 4.50 -0.00 -1.19 -5.00 116.67 122.93 2o5j s ASP 453 Ca 0.10 1.10 0.05 0.00 -0.00 0.00 0.00 52.55 53.79 2o5j s ASP 453 Cb -0.17 -2.54 -0.01 0.00 -0.00 0.00 0.00 42.92 40.20 2o5j s ASP 453 CO -0.25 -1.36 -0.16 0.00 -0.00 0.00 0.00 175.17 173.40 2o5j s ALA 454 N 5.33 1.42 0.08 5.23 0.00 -1.26 -1.74 121.76 130.81 2o5j s ALA 454 Ca 0.64 -0.68 0.04 0.00 0.00 0.00 0.00 51.96 51.96 2o5j s ALA 454 Cb -0.17 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.50 2o5j s ALA 454 CO 0.30 0.30 -0.12 1.03 0.00 0.00 0.00 175.76 177.27 2o5j s ARG 455 N -0.17 0.79 -0.11 0.00 3.00 -0.79 -4.94 118.95 116.74 2o5j s ARG 455 Ca 0.01 -1.00 -0.05 0.00 0.00 0.00 0.00 55.73 54.70 2o5j s ARG 455 Cb -0.09 -0.66 0.05 0.00 0.00 0.00 0.00 34.95 34.25 2o5j s ARG 455 CO 0.01 0.13 0.25 0.00 0.00 0.00 0.00 175.30 175.69 2o5j s MET 456 N -2.06 0.20 0.00 3.54 0.23 -1.26 -2.65 119.30 117.30 2o5j s MET 456 Ca -0.01 0.58 0.00 0.00 -1.03 0.00 0.00 55.69 55.23 2o5j s MET 456 Cb -0.08 -0.10 0.00 0.00 -1.53 0.00 0.00 34.83 33.12 2o5j s MET 456 CO 0.01 -0.19 0.00 0.41 -2.03 0.00 0.00 175.02 173.23 2o5j n GLY 457 N 4.45 -1.49 0.21 3.16 0.00 -1.26 -4.40 105.19 105.85 2o5j n GLY 457 Ca -0.22 -2.17 0.12 0.00 0.00 0.00 0.00 46.02 43.76 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 1.07 -0.31 4.61 0.00 -1.84 0.45 119.26 123.24 2o5j h ALA 458 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.97 2o5j h ALA 458 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2o5j h ALA 458 CO 0.00 -0.07 -0.02 1.49 0.00 0.00 0.00 179.25 180.65 2o5j h GLU 459 N 0.00 0.06 -0.13 0.00 4.81 -1.77 0.23 114.58 117.78 2o5j h GLU 459 Ca 0.00 -0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2o5j h GLU 459 Cb 0.19 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2o5j h GLU 459 CO 0.00 0.04 -0.03 0.00 -0.73 0.00 0.00 179.01 178.29 2o5j h ALA 460 N 1.28 0.09 0.00 2.92 0.00 -0.30 -2.75 119.26 120.50 2o5j h ALA 460 Ca 0.15 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 2o5j h ALA 460 Cb 0.21 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2o5j h ALA 460 CO -0.27 -0.48 -0.44 0.82 0.00 0.00 0.00 179.25 178.88 2o5j h ILE 461 N 0.01 0.68 -0.72 0.00 1.08 -1.51 -2.72 117.51 114.33 2o5j h ILE 461 Ca 0.06 -1.97 0.03 0.00 -0.39 0.00 0.00 64.86 62.59 2o5j h ILE 461 Cb 0.09 2.32 -0.04 0.00 -3.07 0.00 0.00 36.82 36.12 2o5j h ILE 461 CO -0.13 0.39 0.45 -0.61 -0.69 0.00 0.00 178.15 177.56 2o5j h GLN 462 N 0.00 0.86 0.52 2.37 4.15 -0.27 -0.40 115.11 122.34 2o5j h GLN 462 Ca -0.01 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 2o5j h GLN 462 Cb 1.31 -0.19 0.01 0.00 0.21 0.00 0.00 27.48 28.82 2o5j h GLN 462 CO 0.05 0.57 -0.25 1.96 -1.93 0.00 0.00 178.83 179.23 2o5j h GLN 463 N 0.89 -0.67 -1.03 1.69 1.08 -1.41 -2.77 115.11 112.88 2o5j h GLN 463 Ca 0.29 0.05 0.26 0.00 -1.45 0.00 0.00 58.65 57.79 2o5j h GLN 463 Cb 0.01 0.15 -0.11 0.00 -0.05 0.00 0.00 27.48 27.48 2o5j h GLN 463 CO -0.11 -0.45 0.64 1.25 -0.95 0.00 0.00 178.83 179.22 2o5j h LEU 464 N -0.87 0.55 -0.78 1.46 6.46 -1.46 0.39 115.31 121.05 2o5j h LEU 464 Ca -0.07 0.11 -0.11 0.00 -0.12 0.00 0.00 57.88 57.68 2o5j h LEU 464 Cb 0.53 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.47 2o5j h LEU 464 CO 0.12 0.09 -0.29 0.25 -0.62 0.00 0.00 178.44 177.99 2o5j h LEU 465 N 0.48 0.61 -0.18 2.25 6.46 -1.06 -3.08 115.31 120.79 2o5j h LEU 465 Ca 0.62 -0.23 -0.22 0.00 -0.12 0.00 0.00 57.88 57.93 2o5j h LEU 465 Cb 1.40 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 41.16 2o5j h LEU 465 CO -0.38 0.87 -0.95 0.11 -0.62 0.00 0.00 178.44 177.47 2o5j h LYS 466 N 0.51 0.30 0.00 1.25 1.57 -0.65 -3.26 116.57 116.30 2o5j h LYS 466 Ca 0.07 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2o5j h LYS 466 Cb 0.76 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.18 2o5j h LYS 466 CO 0.06 1.05 0.00 -1.91 -0.57 0.00 0.00 179.45 178.09 2o5j n GLU 467 N -3.68 0.78 -3.52 3.15 2.13 -0.83 -4.79 120.64 113.88 2o5j n GLU 467 Ca -0.06 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.38 2o5j n GLU 467 Cb 0.85 -1.47 -0.10 0.00 0.27 0.00 0.00 31.44 30.99 2o5j n GLU 467 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2o5j s LEU 468 N -1.94 4.05 -1.08 4.31 1.43 -1.22 -5.00 118.68 119.23 2o5j s LEU 468 Ca 0.35 0.15 -0.14 0.00 -1.03 0.00 0.00 54.13 53.46 2o5j s LEU 468 Cb 0.16 -2.25 0.18 0.00 0.03 0.00 0.00 46.19 44.31 2o5j s LEU 468 CO 0.27 -0.08 1.22 -1.81 0.23 0.00 0.00 176.35 176.18 2o5j s ASP 469 N 1.56 6.97 0.18 2.29 -0.00 -1.26 -4.90 116.67 121.51 2o5j s ASP 469 Ca 0.11 -2.82 0.00 0.00 -0.00 0.00 0.00 52.55 49.84 2o5j s ASP 469 Cb -0.15 -2.35 0.43 0.00 -0.00 0.00 0.00 42.92 40.85 2o5j s ASP 469 CO 0.09 -0.73 0.94 0.18 -0.00 0.00 0.00 175.17 175.65 2o5j n LEU 470 N 5.18 -0.09 -0.12 1.23 4.77 -1.26 0.43 117.00 127.14 2o5j n LEU 470 Ca 0.29 1.02 -0.05 0.00 -0.03 0.00 0.00 56.01 57.23 2o5j n LEU 470 Cb 0.44 -0.36 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 2o5j n LEU 470 CO 0.53 -1.02 0.75 -0.33 -1.33 0.00 0.00 177.39 175.99 2o5j h GLU 471 N 0.00 -0.07 -0.19 3.23 4.39 -1.96 0.52 114.58 120.48 2o5j h GLU 471 Ca 0.35 0.01 0.04 0.00 0.34 0.00 0.00 59.36 60.09 2o5j h GLU 471 Cb 0.70 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.33 2o5j h GLU 471 CO -0.57 -0.05 -0.03 0.00 -1.16 0.00 0.00 179.01 177.20 2o5j h ALA 472 N 1.25 0.15 0.00 3.43 0.00 -0.44 0.02 119.26 123.66 2o5j h ALA 472 Ca 0.19 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2o5j h ALA 472 Cb 0.37 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2o5j h ALA 472 CO -0.45 -0.46 -0.10 -0.07 0.00 0.00 0.00 179.25 178.17 2o5j h LEU 473 N 0.03 0.00 0.67 0.00 4.07 -1.27 -1.18 115.31 117.62 2o5j h LEU 473 Ca 0.09 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.02 2o5j h LEU 473 Cb 0.13 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.88 2o5j h LEU 473 CO -0.18 0.10 -0.32 -0.08 -1.08 0.00 0.00 178.44 176.88 2o5j h GLU 474 N 0.00 -0.86 0.37 1.13 4.81 0.18 -1.20 114.58 119.01 2o5j h GLU 474 Ca -0.00 0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2o5j h GLU 474 Cb 0.63 0.20 -0.03 0.00 0.63 0.00 0.00 28.75 30.18 2o5j h GLU 474 CO 0.01 -0.55 -0.43 0.87 -0.73 0.00 0.00 179.01 178.18 2o5j h LYS 475 N -1.01 -0.81 -0.89 1.92 1.57 -1.03 -0.64 116.57 115.70 2o5j h LYS 475 Ca -0.09 0.06 0.21 0.00 -1.87 0.00 0.00 60.65 58.95 2o5j h LYS 475 Cb 0.72 0.18 -0.16 0.00 0.08 0.00 0.00 32.23 33.05 2o5j h LYS 475 CO 0.15 -0.54 -0.05 1.49 -0.57 0.00 0.00 179.45 179.93 2o5j h GLU 476 N -0.84 0.04 -0.16 3.15 4.81 -1.25 0.43 114.58 120.76 2o5j h GLU 476 Ca -0.03 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2o5j h GLU 476 Cb 0.76 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 2o5j h GLU 476 CO -0.10 0.03 0.04 -0.07 -0.73 0.00 0.00 179.01 178.18 2o5j h LEU 477 N 0.04 0.23 -0.71 1.64 3.38 -0.94 -0.53 115.31 118.42 2o5j h LEU 477 Ca 0.49 -0.22 0.13 0.00 0.09 0.00 0.00 57.88 58.37 2o5j h LEU 477 Cb 0.89 -0.06 -0.13 0.00 0.09 0.00 0.00 40.66 41.45 2o5j h LEU 477 CO -0.84 0.39 -0.27 -0.07 0.09 0.00 0.00 178.44 177.74 2o5j h LEU 478 N 0.07 -0.98 0.07 1.67 3.38 0.14 0.79 115.31 120.46 2o5j h LEU 478 Ca 0.05 0.24 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 2o5j h LEU 478 Cb 0.24 0.54 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2o5j h LEU 478 CO -0.00 -0.28 -0.04 -0.33 0.09 0.00 0.00 178.44 177.89 2o5j h GLU 479 N -0.07 -0.09 -0.57 1.13 4.39 -1.25 -2.82 114.58 115.30 2o5j h GLU 479 Ca 0.30 0.01 0.14 0.00 0.34 0.00 0.00 59.36 60.15 2o5j h GLU 479 Cb 0.56 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.20 2o5j h GLU 479 CO -0.76 0.14 0.40 1.49 -1.16 0.00 0.00 179.01 179.12 2o5j h GLU 480 N -0.32 0.14 0.22 2.33 4.57 0.65 -2.55 114.58 119.62 2o5j h GLU 480 Ca -0.01 -0.01 -0.32 0.00 -1.18 0.00 0.00 59.36 57.84 2o5j h GLU 480 Cb 0.28 -0.03 0.03 0.00 -0.16 0.00 0.00 28.75 28.86 2o5j h GLU 480 CO 0.02 0.09 -1.49 1.98 -1.18 0.00 0.00 179.01 178.43 2o5j h MET 481 N 0.14 0.46 0.00 1.92 4.05 0.77 -3.33 114.93 118.94 2o5j h MET 481 Ca 0.27 -0.78 0.00 0.00 -0.28 0.00 0.00 59.70 58.91 2o5j h MET 481 Cb 0.87 0.29 0.00 0.00 -0.80 0.00 0.00 31.60 31.96 2o5j h MET 481 CO -0.04 1.38 -0.49 1.17 0.23 0.00 0.00 176.91 179.16 2o5j n LYS 482 N -3.74 0.07 -0.02 0.39 4.81 -1.14 -4.67 118.16 113.86 2o5j n LYS 482 Ca -0.20 0.02 -0.02 0.00 -0.87 0.00 0.00 58.31 57.24 2o5j n LYS 482 Cb 1.06 -1.54 -0.01 0.00 0.02 0.00 0.00 35.03 34.56 2o5j n LYS 482 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2o5j n HIS 483 N -1.64 0.00 -0.18 5.64 8.25 -0.97 -5.01 115.22 121.30 2o5j n HIS 483 Ca 0.05 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.32 2o5j n HIS 483 Cb 0.36 -0.14 0.19 0.00 1.12 0.00 0.00 29.99 31.52 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 -3.05 -3.52 -0.89 -0.41 -0.02 -1.25 -4.98 135.00 120.88 2o5j n PRO 484 Ca -0.04 -0.93 -0.29 0.00 -2.02 0.00 0.00 63.50 60.23 2o5j n PRO 484 Cb 0.14 -1.27 0.23 0.00 -0.02 0.00 0.00 33.50 32.58 2o5j n PRO 484 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2o5j s SER 485 N -2.61 1.26 0.48 2.55 1.04 -1.26 -4.80 113.70 110.37 2o5j s SER 485 Ca 0.43 1.07 0.19 0.00 0.48 0.00 0.00 55.95 58.11 2o5j s SER 485 Cb -0.08 -1.63 1.19 0.00 0.10 0.00 0.00 66.02 65.61 2o5j s SER 485 CO 0.36 -3.96 2.04 0.03 0.98 0.00 0.00 173.24 172.68 2o5j h ARG 486 N -2.46 0.00 0.51 4.02 3.08 -1.95 -2.94 114.38 114.64 2o5j h ARG 486 Ca -0.53 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.50 2o5j h ARG 486 Cb 1.33 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.38 2o5j h ARG 486 CO 0.47 0.15 -0.31 0.00 -1.07 0.00 0.00 179.97 179.21 2o5j h ALA 487 N 1.85 -1.15 0.00 0.04 0.00 -2.00 -0.45 119.26 117.56 2o5j h ALA 487 Ca -0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2o5j h ALA 487 Cb 0.29 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2o5j h ALA 487 CO 0.02 -1.11 -0.24 0.07 0.00 0.00 0.00 179.25 177.98 2o5j h ARG 488 N -0.76 0.00 -0.00 0.00 0.11 -1.96 -3.27 114.38 108.50 2o5j h ARG 488 Ca -0.07 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.82 2o5j h ARG 488 Cb 0.61 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.68 2o5j h ARG 488 CO 0.08 0.12 -0.84 0.07 0.10 0.00 0.00 179.97 179.49 2o5j h ARG 489 N 0.00 0.18 0.05 0.08 0.11 -1.54 -2.76 114.38 110.50 2o5j h ARG 489 Ca -0.01 -0.19 -0.00 0.00 0.10 0.00 0.00 59.98 59.89 2o5j h ARG 489 Cb 1.10 0.05 0.00 0.00 1.11 0.00 0.00 29.97 32.23 2o5j h ARG 489 CO 0.02 0.92 -0.03 0.00 0.10 0.00 0.00 179.97 180.98 2o5j h ALA 490 N 1.02 -0.07 -0.92 0.08 0.00 -1.12 -2.09 119.26 116.15 2o5j h ALA 490 Ca -0.04 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 54.89 2o5j h ALA 490 Cb 1.45 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 19.20 2o5j h ALA 490 CO 0.13 -0.45 0.59 -0.22 0.00 0.00 0.00 179.25 179.29 2o5j h LYS 491 N -0.24 0.84 0.00 0.00 1.63 -1.61 0.97 116.57 118.16 2o5j h LYS 491 Ca -0.01 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 2o5j h LYS 491 Cb 0.22 -0.19 -0.00 0.00 -0.60 0.00 0.00 32.23 31.65 2o5j h LYS 491 CO 0.01 0.56 -0.12 0.00 -3.45 0.00 0.00 179.45 176.45 2o5j h ALA 492 N 1.56 1.00 0.21 5.00 0.00 -1.32 -2.52 119.26 123.20 2o5j h ALA 492 Ca 0.44 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2o5j h ALA 492 Cb 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2o5j h ALA 492 CO -0.21 0.14 -0.10 0.07 0.00 0.00 0.00 179.25 179.16 2o5j h ARG 493 N 0.00 -0.28 -0.32 0.00 -0.00 -0.09 -1.20 114.38 112.49 2o5j h ARG 493 Ca -0.00 0.02 -0.00 0.00 -0.00 0.00 0.00 59.98 60.00 2o5j h ARG 493 Cb 0.70 0.06 -0.02 0.00 -0.00 0.00 0.00 29.97 30.71 2o5j h ARG 493 CO 0.02 0.08 0.20 -0.22 -0.00 0.00 0.00 179.97 180.04 2o5j h LYS 494 N -0.69 0.43 0.00 0.08 3.64 -1.48 -1.00 116.57 117.54 2o5j h LYS 494 Ca -0.03 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2o5j h LYS 494 Cb 0.48 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 2o5j h LYS 494 CO 0.05 0.30 0.00 -0.09 -2.27 0.00 0.00 179.45 177.43 2o5j h ARG 495 N 0.44 0.00 0.05 1.90 2.43 -1.36 -3.23 114.38 114.61 2o5j h ARG 495 Ca 0.12 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.02 2o5j h ARG 495 Cb -0.02 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 2o5j h ARG 495 CO -0.02 0.00 -1.31 1.25 -1.51 0.00 0.00 179.97 178.37 2o5j h LEU 496 N 0.00 0.17 -0.03 3.80 7.12 0.10 -3.30 115.31 123.17 2o5j h LEU 496 Ca 0.00 -0.22 -0.00 0.00 0.13 0.00 0.00 57.88 57.79 2o5j h LEU 496 Cb 0.76 -0.06 -0.00 0.00 -0.53 0.00 0.00 40.66 40.83 2o5j h LEU 496 CO 0.00 1.18 0.02 -0.33 -0.13 0.00 0.00 178.44 179.18 2o5j h GLU 497 N 0.03 0.05 -0.18 1.25 3.07 -1.55 0.12 114.58 117.37 2o5j h GLU 497 Ca -0.14 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.74 2o5j h GLU 497 Cb 1.91 -0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 29.76 2o5j h GLU 497 CO 0.14 0.13 -0.42 0.28 -1.40 0.00 0.00 179.01 177.74 2o5j h VAL 498 N -0.05 0.00 -0.81 3.13 2.07 -1.70 0.36 116.25 119.26 2o5j h VAL 498 Ca 0.01 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.66 2o5j h VAL 498 Cb 0.09 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.78 2o5j h VAL 498 CO -0.00 0.00 0.41 0.58 0.02 0.00 0.00 177.57 178.58 2o5j h VAL 499 N -0.39 0.78 0.28 2.57 2.07 -1.63 -2.48 116.25 117.46 2o5j h VAL 499 Ca 0.04 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 2o5j h VAL 499 Cb 0.49 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2o5j h VAL 499 CO -0.38 0.12 -0.40 0.03 0.02 0.00 0.00 177.57 176.95 2o5j h ARG 500 N 0.63 -0.69 -0.87 1.57 2.47 0.14 -2.83 114.38 114.80 2o5j h ARG 500 Ca 0.42 0.05 0.22 0.00 -1.26 0.00 0.00 59.98 59.41 2o5j h ARG 500 Cb 0.54 0.16 -0.15 0.00 -1.65 0.00 0.00 29.97 28.86 2o5j h ARG 500 CO -0.33 -0.46 0.07 0.00 0.56 0.00 0.00 179.97 179.81 2o5j h ALA 501 N -0.97 1.04 0.29 0.04 0.00 0.03 0.54 119.26 120.23 2o5j h ALA 501 Ca -0.03 0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2o5j h ALA 501 Cb 0.65 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2o5j h ALA 501 CO -0.12 -0.49 -0.17 0.74 0.00 0.00 0.00 179.25 179.21 2o5j h PHE 502 N 0.09 -0.46 -0.53 0.00 0.05 -1.22 -2.16 116.94 112.71 2o5j h PHE 502 Ca 0.52 -0.01 0.09 0.00 3.82 0.00 0.00 57.97 62.39 2o5j h PHE 502 Cb 1.00 0.16 -0.07 0.00 2.00 0.00 0.00 35.95 39.05 2o5j h PHE 502 CO -0.42 -0.26 0.13 -0.07 -0.18 0.00 0.00 178.31 177.52 2o5j h LEU 503 N -0.43 0.06 0.62 1.54 3.38 -1.28 -0.98 115.31 118.21 2o5j h LEU 503 Ca -0.04 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2o5j h LEU 503 Cb 0.34 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2o5j h LEU 503 CO 0.04 0.05 -0.43 -0.78 0.09 0.00 0.00 178.44 177.41 2o5j h ASP 504 N 0.28 -1.13 0.72 -0.43 -0.00 -0.88 -3.00 116.42 111.99 2o5j h ASP 504 Ca 0.27 0.07 -0.07 0.00 -0.00 0.00 0.00 57.03 57.30 2o5j h ASP 504 Cb 0.35 0.34 -0.01 0.00 -0.00 0.00 0.00 39.33 40.01 2o5j h ASP 504 CO -0.32 -0.64 -0.34 -1.28 -0.00 0.00 0.00 179.24 176.66 2o5j h SER 505 N -1.00 0.00 0.00 2.28 0.87 -1.40 -3.49 113.55 110.81 2o5j h SER 505 Ca -0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 2o5j h SER 505 Cb 0.82 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 2o5j h SER 505 CO 0.05 0.34 0.00 0.61 -0.53 0.00 0.00 176.83 177.30 2o5j n GLY 506 N 0.02 1.84 0.00 5.77 0.00 -0.38 -4.89 105.19 107.56 2o5j n GLY 506 Ca -0.01 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 0.02 0.00 -4.79 1.61 5.03 -1.26 -4.29 115.26 111.57 2o5j n ASN 507 Ca 0.00 0.00 -0.33 0.00 0.87 0.00 0.00 54.58 55.12 2o5j n ASN 507 Cb 0.00 0.00 0.01 0.00 -1.02 0.00 0.00 39.78 38.77 2o5j n ASN 507 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2o5j s ARG 508 N 0.00 3.32 0.00 3.52 0.52 -1.26 -4.75 118.95 120.30 2o5j s ARG 508 Ca 0.00 1.31 0.23 0.00 -0.52 0.00 0.00 55.73 56.75 2o5j s ARG 508 Cb 0.00 -2.03 1.36 0.00 0.52 0.00 0.00 34.95 34.80 2o5j s ARG 508 CO 0.00 -0.82 1.76 -0.35 0.02 0.00 0.00 175.30 175.90 2o5j n PRO 509 N -1.83 0.68 0.00 3.54 -0.04 -1.26 -3.95 135.00 132.14 2o5j n PRO 509 Ca 0.09 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.67 2o5j n PRO 509 Cb 0.52 -1.50 0.50 0.00 -0.04 0.00 0.00 33.50 32.99 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 -1.03 0.14 -0.02 0.54 4.71 -1.26 -2.96 120.64 120.76 2o5j n GLU 510 Ca 0.17 0.11 0.13 0.00 -0.01 0.00 0.00 57.16 57.55 2o5j n GLU 510 Cb 0.09 -1.50 0.56 0.00 -1.01 0.00 0.00 31.44 29.58 2o5j n GLU 510 CO 0.00 0.00 0.00 0.91 0.09 0.00 0.00 177.13 178.13 2o5j n TRP 511 N -1.40 0.06 0.27 -0.32 5.03 -1.25 -3.78 117.44 116.04 2o5j n TRP 511 Ca 0.08 -0.03 0.14 0.00 3.03 0.00 0.00 57.50 60.71 2o5j n TRP 511 Cb 0.22 0.00 0.73 0.00 -1.03 0.00 0.00 31.31 31.23 2o5j n TRP 511 CO 0.00 0.00 0.00 1.98 -0.03 0.00 0.00 177.69 179.64 2o5j h MET 512 N 1.53 0.00 -6.24 -0.99 4.05 -1.85 -3.42 114.93 108.00 2o5j h MET 512 Ca 0.00 0.00 -0.57 0.00 -0.28 0.00 0.00 59.70 58.85 2o5j h MET 512 Cb 0.33 0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.09 2o5j h MET 512 CO 0.00 0.11 -0.04 0.96 0.23 0.00 0.00 176.91 178.17 2o5j s ILE 513 N -4.07 4.75 -0.24 1.77 -4.36 -1.25 -4.33 121.20 113.47 2o5j s ILE 513 Ca -0.02 1.17 -0.09 0.00 -0.26 0.00 0.00 60.65 61.45 2o5j s ILE 513 Cb 0.12 -3.88 -0.04 0.00 1.25 0.00 0.00 42.46 39.92 2o5j s ILE 513 CO 0.57 0.52 0.11 -0.76 0.24 0.00 0.00 174.94 175.62 2o5j s LEU 514 N -1.21 3.73 0.00 0.37 1.43 -1.18 -4.89 118.68 116.93 2o5j s LEU 514 Ca 0.30 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.33 2o5j s LEU 514 Cb -0.19 -2.00 0.00 0.00 0.03 0.00 0.00 46.19 44.03 2o5j s LEU 514 CO 0.19 0.01 0.00 -1.84 0.23 0.00 0.00 176.35 174.94 2o5j n GLU 515 N 4.63 4.81 -3.78 1.70 0.28 -1.26 -3.53 120.64 123.48 2o5j n GLU 515 Ca -0.16 0.00 -0.27 0.00 -0.16 0.00 0.00 57.16 56.58 2o5j n GLU 515 Cb 0.52 -0.45 -0.17 0.00 1.43 0.00 0.00 31.44 32.77 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 -0.87 1.08 -0.48 -1.84 0.00 -1.26 -2.38 121.76 116.01 2o5j s ALA 516 Ca 0.00 -0.63 -0.18 0.00 0.00 0.00 0.00 51.96 51.15 2o5j s ALA 516 Cb 0.00 -1.09 0.06 0.00 0.00 0.00 0.00 23.12 22.09 2o5j s ALA 516 CO 0.00 -0.94 0.51 0.08 0.00 0.00 0.00 175.76 175.41 2o5j s VAL 517 N 1.81 5.04 0.17 0.00 1.01 0.26 -4.87 120.40 123.82 2o5j s VAL 517 Ca 0.00 -0.67 -0.31 0.00 0.00 0.00 0.00 61.98 61.00 2o5j s VAL 517 Cb -0.16 -4.20 -0.10 0.00 0.00 0.00 0.00 36.38 31.93 2o5j s VAL 517 CO -0.07 -0.66 1.51 -2.84 0.00 0.00 0.00 175.10 173.04 2o5j s PRO 518 N 2.20 4.24 -0.09 2.72 0.02 -1.26 0.26 135.00 143.09 2o5j s PRO 518 Ca 0.11 2.30 -0.13 0.00 0.02 0.00 0.00 61.00 63.30 2o5j s PRO 518 Cb -0.21 -3.16 -0.05 0.00 0.02 0.00 0.00 34.50 31.10 2o5j s PRO 518 CO 0.10 -0.54 0.31 0.08 -0.33 0.00 0.00 177.00 176.62 2o5j s VAL 519 N 0.89 5.25 0.59 3.83 1.01 1.97 -4.84 120.40 129.10 2o5j s VAL 519 Ca 0.67 0.59 -0.16 0.00 0.00 0.00 0.00 61.98 63.07 2o5j s VAL 519 Cb -0.42 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 2o5j s VAL 519 CO 0.34 0.51 1.08 -0.22 0.00 0.00 0.00 175.10 176.80 2o5j s LEU 520 N -0.43 3.53 0.72 3.92 2.96 -1.26 0.13 118.68 128.24 2o5j s LEU 520 Ca 0.19 1.91 -0.16 0.00 -0.22 0.00 0.00 54.13 55.85 2o5j s LEU 520 Cb -0.14 -4.55 -0.03 0.00 0.50 0.00 0.00 46.19 41.97 2o5j s LEU 520 CO 0.08 -1.25 0.63 -0.81 -1.32 0.00 0.00 176.35 173.67 2o5j n PRO 521 N -1.95 0.35 0.03 0.98 -0.04 -0.93 -4.48 135.00 128.96 2o5j n PRO 521 Ca 0.09 0.16 -0.11 0.00 -0.04 0.00 0.00 63.50 63.60 2o5j n PRO 521 Cb 0.52 -1.91 -0.09 0.00 -0.04 0.00 0.00 33.50 31.99 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 -0.33 -0.14 0.00 0.54 0.13 -1.74 -3.26 132.00 127.20 2o5j h PRO 522 Ca -0.46 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2o5j h PRO 522 Cb 1.35 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2o5j h PRO 522 CO 0.44 0.35 0.00 -0.44 -0.23 0.00 0.00 178.00 178.12 2o5j h ASP 523 N -0.80 0.00 -0.35 1.44 3.32 -1.80 -2.51 116.42 115.71 2o5j h ASP 523 Ca -0.02 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 2o5j h ASP 523 Cb 0.56 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 2o5j h ASP 523 CO 0.03 0.00 -0.13 0.25 -1.72 0.00 0.00 179.24 177.67 2o5j h LEU 524 N 0.00 0.73 -6.96 1.55 5.85 -1.75 -3.32 115.31 111.40 2o5j h LEU 524 Ca 0.00 -0.39 -0.76 0.00 0.84 0.00 0.00 57.88 57.57 2o5j h LEU 524 Cb 0.04 -0.20 -0.31 0.00 0.37 0.00 0.00 40.66 40.56 2o5j h LEU 524 CO 0.00 0.95 0.42 -2.11 -0.34 0.00 0.00 178.44 177.37 2o5j n ARG 525 N -4.35 3.83 -0.85 1.25 0.00 -0.94 -5.03 116.66 110.56 2o5j n ARG 525 Ca -0.02 -4.55 -0.31 0.00 -0.00 0.00 0.00 57.85 52.97 2o5j n ARG 525 Cb 0.37 -2.47 -0.03 0.00 -0.00 0.00 0.00 32.46 30.34 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 1.58 0.00 -3.90 2.89 -0.02 -1.25 -4.06 135.00 130.25 2o5j n PRO 526 Ca 0.26 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.44 2o5j n PRO 526 Cb 0.36 -0.70 -0.12 0.00 -0.02 0.00 0.00 33.50 33.01 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 -0.36 2.30 0.11 -0.52 1.75 -1.25 -3.01 119.30 118.32 2o5j s MET 527 Ca 0.44 -2.98 0.07 0.00 -1.25 0.00 0.00 55.69 51.96 2o5j s MET 527 Cb -0.62 -3.43 -0.04 0.00 2.84 0.00 0.00 34.83 33.58 2o5j s MET 527 CO 0.33 -1.20 -0.07 0.08 -0.65 0.00 0.00 175.02 173.51 2o5j s VAL 528 N -0.86 3.52 -0.30 10.11 1.01 -0.20 -4.96 120.40 128.72 2o5j s VAL 528 Ca 0.21 -1.24 -0.25 0.00 0.00 0.00 0.00 61.98 60.69 2o5j s VAL 528 Cb -0.15 -2.67 0.00 0.00 0.00 0.00 0.00 36.38 33.56 2o5j s VAL 528 CO -0.08 0.08 0.88 -1.58 0.00 0.00 0.00 175.10 174.40 2o5j s GLN 529 N -2.32 4.04 0.00 2.72 0.74 -1.26 -0.47 119.66 123.10 2o5j s GLN 529 Ca 0.23 0.81 0.00 0.00 0.05 0.00 0.00 55.36 56.45 2o5j s GLN 529 Cb -0.11 -3.71 0.00 0.00 1.10 0.00 0.00 33.01 30.29 2o5j s GLN 529 CO 0.15 -0.71 0.00 0.28 -0.55 0.00 0.00 175.29 174.46 2o5j n VAL 530 N 5.56 0.00 -3.79 1.34 0.31 0.31 -4.94 118.33 117.12 2o5j n VAL 530 Ca 0.07 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.26 2o5j n VAL 530 Cb 0.48 -0.26 -0.15 0.00 -0.91 0.00 0.00 33.84 32.99 2o5j n VAL 530 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2o5j s ASP 531 N -1.00 -0.03 0.00 4.52 2.15 -1.24 -4.84 116.67 116.23 2o5j s ASP 531 Ca 0.00 0.15 0.00 0.00 0.43 0.00 0.00 52.55 53.13 2o5j s ASP 531 Cb 0.00 0.08 0.00 0.00 -0.30 0.00 0.00 42.92 42.70 2o5j s ASP 531 CO 0.00 -0.10 0.00 0.61 -0.17 0.00 0.00 175.17 175.51 2o5j n GLY 532 N 3.85 1.03 0.00 2.66 0.00 -1.26 -1.68 105.19 109.79 2o5j n GLY 532 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.89 -0.28 3.77 -0.02 0.00 -1.26 -5.13 105.19 100.39 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 4.35 -0.07 1.61 0.52 -0.68 -4.86 118.95 119.83 2o5j s ARG 534 Ca 0.00 2.22 0.04 0.00 -0.52 0.00 0.00 55.73 57.47 2o5j s ARG 534 Cb 0.00 -3.07 0.00 0.00 0.52 0.00 0.00 34.95 32.40 2o5j s ARG 534 CO 0.00 -0.19 -0.18 -0.06 0.02 0.00 0.00 175.30 174.89 2o5j s PHE 535 N -1.14 1.94 -0.09 -0.53 0.08 -1.26 0.11 117.98 117.09 2o5j s PHE 535 Ca 0.49 -0.69 0.01 0.00 0.12 0.00 0.00 56.93 56.87 2o5j s PHE 535 Cb -0.40 -1.33 -0.02 0.00 -0.57 0.00 0.00 43.02 40.70 2o5j s PHE 535 CO 0.53 -0.28 -0.12 0.00 -0.10 0.00 0.00 175.22 175.25 2o5j s ALA 536 N 0.31 2.73 0.04 5.36 0.00 0.38 -4.93 121.76 125.65 2o5j s ALA 536 Ca -0.12 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 50.91 2o5j s ALA 536 Cb -0.15 -1.14 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 2o5j s ALA 536 CO 0.05 0.43 -0.01 -0.08 0.00 0.00 0.00 175.76 176.16 2o5j s THR 537 N -0.31 0.17 -0.17 0.00 -1.32 -1.24 -1.04 115.64 111.73 2o5j s THR 537 Ca 0.03 -1.39 -0.29 0.00 -1.21 0.00 0.00 61.69 58.83 2o5j s THR 537 Cb -0.13 -1.01 -0.01 0.00 -1.51 0.00 0.00 72.50 69.84 2o5j s THR 537 CO 0.03 -0.77 1.24 -0.55 -2.21 0.00 0.00 174.62 172.36 2o5j s SER 538 N -2.32 6.96 0.55 8.08 0.15 -1.16 -4.89 113.70 121.07 2o5j s SER 538 Ca -0.02 1.66 0.36 0.00 0.70 0.00 0.00 55.95 58.65 2o5j s SER 538 Cb 0.01 -2.54 1.25 0.00 -1.71 0.00 0.00 66.02 63.03 2o5j s SER 538 CO -0.06 -0.75 1.35 0.47 1.20 0.00 0.00 173.24 175.44 2o5j n ASP 539 N 6.55 0.00 -0.08 5.45 10.43 -1.26 -0.96 116.55 136.68 2o5j n ASP 539 Ca 0.14 0.83 0.24 0.00 2.57 0.00 0.00 54.79 58.57 2o5j n ASP 539 Cb 0.45 -0.36 0.71 0.00 1.84 0.00 0.00 41.12 43.76 2o5j n ASP 539 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 2o5j h LEU 540 N 0.00 0.00 -1.02 0.64 4.07 -1.90 0.73 115.31 117.83 2o5j h LEU 540 Ca 0.68 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.61 2o5j h LEU 540 Cb 3.18 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 44.88 2o5j h LEU 540 CO -0.01 0.00 0.33 0.78 -1.08 0.00 0.00 178.44 178.46 2o5j h ASN 541 N 0.00 0.93 -0.51 -0.43 2.35 -1.44 -0.75 115.58 115.73 2o5j h ASN 541 Ca 0.33 -0.11 0.07 0.00 -0.55 0.00 0.00 56.30 56.04 2o5j h ASN 541 Cb 1.37 -0.24 -0.06 0.00 0.05 0.00 0.00 38.32 39.44 2o5j h ASN 541 CO -0.00 0.80 0.20 0.44 -1.65 0.00 0.00 177.43 177.22 2o5j h ASP 542 N 1.02 0.23 -0.01 5.81 3.45 -1.07 0.03 116.42 125.87 2o5j h ASP 542 Ca 0.25 0.06 -0.00 0.00 0.43 0.00 0.00 57.03 57.76 2o5j h ASP 542 Cb 0.13 0.03 -0.00 0.00 -0.56 0.00 0.00 39.33 38.92 2o5j h ASP 542 CO -0.03 0.16 0.00 -0.07 -1.57 0.00 0.00 179.24 177.73 2o5j h LEU 543 N 0.39 0.01 -1.03 1.55 3.38 -1.49 -2.00 115.31 116.13 2o5j h LEU 543 Ca 0.25 -0.21 0.16 0.00 0.09 0.00 0.00 57.88 58.17 2o5j h LEU 543 Cb 0.25 -0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.90 2o5j h LEU 543 CO -0.23 0.22 0.62 1.88 0.09 0.00 0.00 178.44 181.01 2o5j h TYR 544 N -0.19 1.08 0.41 1.13 0.05 -0.75 0.71 116.97 119.42 2o5j h TYR 544 Ca 0.00 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 2o5j h TYR 544 Cb 0.21 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 37.60 2o5j h TYR 544 CO -0.01 0.33 -0.29 0.00 -1.05 0.00 0.00 178.16 177.15 2o5j h ARG 545 N 0.86 -0.66 -0.77 4.88 3.08 -0.66 0.78 114.38 121.89 2o5j h ARG 545 Ca 0.54 0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.71 2o5j h ARG 545 Cb 0.72 0.15 -0.11 0.00 0.08 0.00 0.00 29.97 30.80 2o5j h ARG 545 CO -0.32 -0.44 -0.54 0.00 -1.07 0.00 0.00 179.97 177.61 2o5j h ARG 546 N -0.68 -0.14 0.03 0.04 3.08 -0.18 0.28 114.38 116.81 2o5j h ARG 546 Ca -0.04 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.05 2o5j h ARG 546 Cb 0.58 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.62 2o5j h ARG 546 CO 0.02 -0.10 -0.23 1.25 -1.07 0.00 0.00 179.97 179.84 2o5j h LEU 547 N -0.15 -0.66 -0.17 3.04 5.85 -0.96 -2.06 115.31 120.20 2o5j h LEU 547 Ca 0.16 0.09 0.05 0.00 0.84 0.00 0.00 57.88 59.01 2o5j h LEU 547 Cb 0.50 0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.73 2o5j h LEU 547 CO -0.81 -0.30 -0.42 0.40 -0.34 0.00 0.00 178.44 176.97 2o5j h ILE 548 N -0.38 0.14 0.14 4.05 1.08 0.10 -1.28 117.51 121.36 2o5j h ILE 548 Ca 0.05 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.53 2o5j h ILE 548 Cb 0.44 0.14 -0.02 0.00 -3.07 0.00 0.00 36.82 34.31 2o5j h ILE 548 CO -0.18 0.00 -0.17 0.78 -0.69 0.00 0.00 178.15 177.89 2o5j h ASN 549 N -0.47 -0.46 -0.48 1.72 -0.26 -0.40 -0.58 115.58 114.65 2o5j h ASN 549 Ca 0.08 0.05 0.09 0.00 -0.56 0.00 0.00 56.30 55.96 2o5j h ASN 549 Cb 0.62 0.17 -0.08 0.00 -1.06 0.00 0.00 38.32 37.97 2o5j h ASN 549 CO -0.42 -0.25 0.03 -0.09 -1.06 0.00 0.00 177.43 175.63 2o5j h ARG 550 N -0.35 0.14 -0.62 0.81 9.65 -1.08 0.44 114.38 123.37 2o5j h ARG 550 Ca 0.01 -0.01 0.03 0.00 -1.10 0.00 0.00 59.98 58.91 2o5j h ARG 550 Cb 0.35 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.86 2o5j h ARG 550 CO -0.07 0.09 0.38 -0.97 2.80 0.00 0.00 179.97 182.21 2o5j h ASN 551 N 0.14 0.62 0.83 -3.80 -1.24 -0.91 0.43 115.58 111.65 2o5j h ASN 551 Ca 0.24 0.00 -0.04 0.00 0.71 0.00 0.00 56.30 57.22 2o5j h ASN 551 Cb 0.35 -0.13 0.01 0.00 0.73 0.00 0.00 38.32 39.28 2o5j h ASN 551 CO -0.38 0.43 -0.40 0.78 -1.29 0.00 0.00 177.43 176.57 2o5j h ASN 552 N 0.74 -0.95 -1.01 1.15 4.21 -0.08 -1.71 115.58 117.94 2o5j h ASN 552 Ca 0.25 0.03 0.27 0.00 1.21 0.00 0.00 56.30 58.06 2o5j h ASN 552 Cb 0.03 0.24 -0.07 0.00 -1.12 0.00 0.00 38.32 37.41 2o5j h ASN 552 CO -0.10 -0.67 0.69 -0.09 -1.29 0.00 0.00 177.43 175.96 2o5j h ARG 553 N -1.14 0.22 0.16 0.81 2.43 0.13 -0.40 114.38 116.60 2o5j h ARG 553 Ca -0.11 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.03 2o5j h ARG 553 Cb 0.86 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 2o5j h ARG 553 CO 0.19 0.14 -0.08 1.25 -1.51 0.00 0.00 179.97 179.96 2o5j h LEU 554 N 0.23 -0.18 -0.72 3.80 5.85 0.13 -0.34 115.31 124.07 2o5j h LEU 554 Ca 0.52 -0.29 0.16 0.00 0.84 0.00 0.00 57.88 59.11 2o5j h LEU 554 Cb 1.64 0.05 -0.12 0.00 0.37 0.00 0.00 40.66 42.60 2o5j h LEU 554 CO -0.15 0.22 0.08 0.11 -0.34 0.00 0.00 178.44 178.36 2o5j h LYS 555 N -0.62 0.16 -0.28 1.25 1.57 -0.17 0.12 116.57 118.60 2o5j h LYS 555 Ca -0.02 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2o5j h LYS 555 Cb 0.46 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 2o5j h LYS 555 CO 0.04 0.11 -0.24 0.87 -0.57 0.00 0.00 179.45 179.65 2o5j h LYS 556 N 0.17 0.54 0.00 3.15 1.57 -1.31 -2.11 116.57 118.58 2o5j h LYS 556 Ca 0.40 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2o5j h LYS 556 Cb 0.70 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2o5j h LYS 556 CO -0.58 0.75 0.00 -0.07 -0.57 0.00 0.00 179.45 178.98 2o5j h LEU 557 N 0.48 0.00 0.21 2.94 3.38 0.97 -0.22 115.31 123.07 2o5j h LEU 557 Ca 0.07 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.71 2o5j h LEU 557 Cb 0.68 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.45 2o5j h LEU 557 CO 0.05 0.00 -1.58 -0.07 0.09 0.00 0.00 178.44 176.93 2o5j h LEU 558 N 0.00 0.69 -0.13 1.67 3.38 -0.71 -3.33 115.31 116.88 2o5j h LEU 558 Ca 0.00 -0.93 -0.08 0.00 0.09 0.00 0.00 57.88 56.96 2o5j h LEU 558 Cb 0.70 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2o5j h LEU 558 CO 0.00 1.73 -0.24 0.00 0.09 0.00 0.00 178.44 180.03 2o5j h ALA 559 N 0.11 0.21 0.14 1.53 0.00 -1.32 -3.34 119.26 116.59 2o5j h ALA 559 Ca -0.30 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.24 2o5j h ALA 559 Cb 2.08 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 19.79 2o5j h ALA 559 CO 0.21 0.18 -0.45 1.96 0.00 0.00 0.00 179.25 181.15 2o5j h GLN 560 N -0.00 -0.67 0.00 0.00 4.20 -1.20 -3.47 115.11 113.97 2o5j h GLN 560 Ca 0.01 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2o5j h GLN 560 Cb 0.82 0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.75 2o5j h GLN 560 CO 0.05 -0.45 0.00 0.41 -0.67 0.00 0.00 178.83 178.18 2o5j n GLY 561 N -1.48 1.70 2.84 3.46 0.00 -1.25 -5.12 105.19 105.34 2o5j n GLY 561 Ca -0.08 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 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 2.62 -0.30 4.61 0.00 -1.26 -4.53 121.76 120.90 2o5j s ALA 562 Ca 0.00 -2.76 -0.29 0.00 0.00 0.00 0.00 51.96 48.91 2o5j s ALA 562 Cb 0.00 -1.98 0.01 0.00 0.00 0.00 0.00 23.12 21.16 2o5j s ALA 562 CO 0.00 -1.97 1.05 -1.25 0.00 0.00 0.00 175.76 173.59 2o5j s PRO 563 N 0.29 4.11 0.02 0.00 0.04 -1.26 -4.93 135.00 133.27 2o5j s PRO 563 Ca 0.16 1.11 -0.04 0.00 0.04 0.00 0.00 61.00 62.27 2o5j s PRO 563 Cb -0.24 -3.71 -0.01 0.00 0.04 0.00 0.00 34.50 30.58 2o5j s PRO 563 CO -0.03 -0.82 0.36 -1.91 0.04 0.00 0.00 177.00 174.64 2o5j n GLU 564 N 6.70 -0.06 -0.27 4.56 0.00 -1.26 -1.51 120.64 128.80 2o5j n GLU 564 Ca 0.11 0.36 -0.07 0.00 0.00 0.00 0.00 57.16 57.56 2o5j n GLU 564 Cb 0.47 -0.53 -0.06 0.00 0.00 0.00 0.00 31.44 31.31 2o5j n GLU 564 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 2o5j n ILE 565 N -3.30 -0.43 0.23 6.31 -0.00 -1.26 -0.23 119.36 120.67 2o5j n ILE 565 Ca 0.00 1.87 0.08 0.00 -0.00 0.00 0.00 62.75 64.70 2o5j n ILE 565 Cb 0.04 -2.34 0.53 0.00 -0.00 0.00 0.00 39.64 37.87 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 0.84 0.17 1.39 2.04 -1.68 -1.76 117.51 118.51 2o5j h ILE 566 Ca 0.10 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 65.03 2o5j h ILE 566 Cb 0.26 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2o5j h ILE 566 CO -0.60 0.23 -0.08 0.40 0.00 0.00 0.00 178.15 178.10 2o5j h ILE 567 N 0.00 0.95 0.07 -0.67 2.04 -0.39 -2.55 117.51 116.95 2o5j h ILE 567 Ca -0.00 -0.71 -0.00 0.00 1.00 0.00 0.00 64.86 65.14 2o5j h ILE 567 Cb 0.53 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 2o5j h ILE 567 CO 0.03 0.16 -0.03 -0.09 0.00 0.00 0.00 178.15 178.22 2o5j h ARG 568 N -0.59 -0.09 -0.98 2.37 9.65 -1.34 0.63 114.38 124.04 2o5j h ARG 568 Ca -0.02 0.01 0.33 0.00 -1.10 0.00 0.00 59.98 59.19 2o5j h ARG 568 Cb 0.44 0.02 -0.17 0.00 -1.39 0.00 0.00 29.97 28.87 2o5j h ARG 568 CO 0.04 0.00 0.36 -0.91 2.80 0.00 0.00 179.97 182.26 2o5j h ASN 569 N -0.15 0.10 0.11 -3.80 4.21 -1.37 0.60 115.58 115.28 2o5j h ASN 569 Ca -0.01 0.24 -0.01 0.00 1.21 0.00 0.00 56.30 57.73 2o5j h ASN 569 Cb 0.13 0.30 0.00 0.00 -1.12 0.00 0.00 38.32 37.63 2o5j h ASN 569 CO 0.02 -0.30 -0.05 -0.08 -1.29 0.00 0.00 177.43 175.72 2o5j h GLU 570 N 0.11 -0.14 -1.08 0.81 4.57 -1.00 -2.86 114.58 114.99 2o5j h GLU 570 Ca 0.71 0.01 0.31 0.00 -1.18 0.00 0.00 59.36 59.21 2o5j h GLU 570 Cb 1.67 0.03 -0.12 0.00 -0.16 0.00 0.00 28.75 30.17 2o5j h GLU 570 CO -0.75 0.35 0.67 0.87 -1.18 0.00 0.00 179.01 178.97 2o5j h LYS 571 N -0.86 0.33 0.46 1.92 1.79 0.12 0.41 116.57 120.74 2o5j h LYS 571 Ca -0.01 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.42 2o5j h LYS 571 Cb 0.56 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.13 2o5j h LYS 571 CO 0.02 0.22 -0.34 0.00 -1.08 0.00 0.00 179.45 178.27 2o5j h ARG 572 N 0.34 -0.75 -1.01 3.15 3.08 0.09 0.13 114.38 119.42 2o5j h ARG 572 Ca 0.68 0.05 0.24 0.00 0.07 0.00 0.00 59.98 61.02 2o5j h ARG 572 Cb 1.72 0.17 -0.12 0.00 0.08 0.00 0.00 29.97 31.82 2o5j h ARG 572 CO -0.42 -0.50 0.60 0.52 -1.07 0.00 0.00 179.97 179.10 2o5j h MET 573 N -0.78 0.59 0.74 0.04 2.86 -0.63 -1.60 114.93 116.15 2o5j h MET 573 Ca -0.06 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.51 2o5j h MET 573 Cb 0.64 -0.13 0.01 0.00 0.06 0.00 0.00 31.60 32.18 2o5j h MET 573 CO 0.02 0.39 -0.36 1.25 1.06 0.00 0.00 176.91 179.28 2o5j h LEU 574 N 0.61 -0.84 -0.37 1.22 5.85 0.11 -0.78 115.31 121.11 2o5j h LEU 574 Ca 0.63 0.01 0.08 0.00 0.84 0.00 0.00 57.88 59.44 2o5j h LEU 574 Cb 1.18 0.22 -0.09 0.00 0.37 0.00 0.00 40.66 42.34 2o5j h LEU 574 CO -0.44 -0.56 -0.34 -0.61 -0.34 0.00 0.00 178.44 176.14 2o5j h GLN 575 N -1.06 -0.27 -0.44 1.25 4.15 -0.19 0.53 115.11 119.09 2o5j h GLN 575 Ca -0.10 0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.42 2o5j h GLN 575 Cb 0.78 0.06 -0.10 0.00 0.21 0.00 0.00 27.48 28.43 2o5j h GLN 575 CO 0.17 -0.18 -0.35 1.49 -1.93 0.00 0.00 178.83 178.03 2o5j h GLU 576 N -0.28 -0.24 -0.68 1.69 4.22 -1.28 0.11 114.58 118.13 2o5j h GLU 576 Ca 0.16 0.02 0.09 0.00 0.08 0.00 0.00 59.36 59.71 2o5j h GLU 576 Cb 0.55 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.78 2o5j h GLU 576 CO -0.53 -0.16 0.31 0.00 -2.18 0.00 0.00 179.01 176.46 2o5j h ALA 577 N 0.75 0.92 -0.25 2.92 0.00 0.11 0.53 119.26 124.24 2o5j h ALA 577 Ca 0.18 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.23 2o5j h ALA 577 Cb 0.55 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2o5j h ALA 577 CO -0.57 -0.10 0.19 0.28 0.00 0.00 0.00 179.25 179.05 2o5j h VAL 578 N 0.54 0.80 -0.03 0.00 2.07 0.94 -0.70 116.25 119.86 2o5j h VAL 578 Ca 0.34 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.85 2o5j h VAL 578 Cb 0.38 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 2o5j h VAL 578 CO -0.28 0.00 -0.03 0.44 0.02 0.00 0.00 177.57 177.72 2o5j h ASP 579 N 0.00 0.07 -0.79 0.57 3.32 0.13 -3.28 116.42 116.44 2o5j h ASP 579 Ca 0.12 -0.49 0.07 0.00 0.02 0.00 0.00 57.03 56.75 2o5j h ASP 579 Cb 0.50 -0.02 -0.10 0.00 0.22 0.00 0.00 39.33 39.93 2o5j h ASP 579 CO -0.00 0.54 -0.47 0.00 -1.72 0.00 0.00 179.24 177.59 2o5j n ALA 580 N -2.36 -0.51 -0.12 3.45 0.00 -0.28 0.11 120.51 120.80 2o5j n ALA 580 Ca -0.08 0.67 -0.09 0.00 0.00 0.00 0.00 53.44 53.94 2o5j n ALA 580 Cb 0.27 -0.05 -0.01 0.00 0.00 0.00 0.00 19.45 19.66 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 0.49 0.49 0.00 -0.00 -1.66 -3.26 115.31 111.36 2o5j h LEU 581 Ca 0.13 -0.13 -0.02 0.00 -0.00 0.00 0.00 57.88 57.85 2o5j h LEU 581 Cb 0.32 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 40.86 2o5j h LEU 581 CO -0.75 0.48 -0.23 -0.07 -0.00 0.00 0.00 178.44 177.87 2o5j h LEU 582 N 0.46 -0.55 -7.25 0.17 3.38 -1.26 0.17 115.31 110.43 2o5j h LEU 582 Ca 0.13 0.02 -0.31 0.00 0.09 0.00 0.00 57.88 57.80 2o5j h LEU 582 Cb 0.13 0.14 -0.37 0.00 0.09 0.00 0.00 40.66 40.65 2o5j h LEU 582 CO -0.02 -0.26 -0.66 -0.62 0.09 0.00 0.00 178.44 176.97 2o5j s ASP 583 N -3.98 0.88 -0.09 -0.43 -1.08 0.30 0.84 116.67 113.10 2o5j s ASP 583 Ca -0.10 0.25 -0.09 0.00 -0.52 0.00 0.00 52.55 52.10 2o5j s ASP 583 Cb 0.01 0.19 -0.04 0.00 -1.46 0.00 0.00 42.92 41.61 2o5j s ASP 583 CO 0.29 -0.25 0.20 0.21 0.52 0.00 0.00 175.17 176.14 2o5j s ASN 584 N 2.27 6.49 0.00 -0.34 3.04 -1.23 -4.00 114.94 121.17 2o5j s ASN 584 Ca 0.04 0.58 0.00 0.00 0.04 0.00 0.00 52.86 53.52 2o5j s ASN 584 Cb -0.12 -2.11 0.00 0.00 -1.54 0.00 0.00 41.25 37.48 2o5j s ASN 584 CO -0.05 0.39 0.00 0.61 -3.04 0.00 0.00 177.10 175.00 2o5j n GLY 585 N 1.92 3.19 0.25 1.21 0.00 -0.62 -4.87 105.19 106.27 2o5j n GLY 585 Ca -0.18 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 1.64 0.23 -2.92 1.61 3.08 -1.98 -3.36 114.38 112.68 2o5j h ARG 586 Ca 0.00 -0.04 -0.53 0.00 0.07 0.00 0.00 59.98 59.48 2o5j h ARG 586 Cb 0.00 -0.04 -0.40 0.00 0.08 0.00 0.00 29.97 29.61 2o5j h ARG 586 CO 0.00 0.31 -0.77 0.50 -1.07 0.00 0.00 179.97 178.94 2o5j s ARG 587 N -4.87 0.26 0.48 0.04 6.06 -1.26 -5.11 118.95 114.54 2o5j s ARG 587 Ca -0.06 -0.57 0.00 0.00 -2.50 0.00 0.00 55.73 52.60 2o5j s ARG 587 Cb 0.16 -1.33 0.00 0.00 0.06 0.00 0.00 34.95 33.84 2o5j s ARG 587 CO 0.72 -0.98 0.00 0.41 -2.50 0.00 0.00 175.30 172.95 2o5j n GLY 588 N 5.19 -2.82 2.83 8.12 0.00 -1.26 -4.90 105.19 112.35 2o5j n GLY 588 Ca -0.06 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 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 -3.47 1.42 0.52 4.61 0.00 -1.26 -1.59 121.76 121.99 2o5j s ALA 589 Ca 0.00 -0.98 -0.22 0.00 0.00 0.00 0.00 51.96 50.76 2o5j s ALA 589 Cb 0.00 -1.28 -0.06 0.00 0.00 0.00 0.00 23.12 21.78 2o5j s ALA 589 CO 0.00 -1.17 1.30 -2.14 0.00 0.00 0.00 175.76 173.75 2o5j s PRO 590 N 1.65 3.35 -0.02 0.00 0.02 -1.26 -4.97 135.00 133.77 2o5j s PRO 590 Ca -0.03 2.09 0.03 0.00 0.02 0.00 0.00 61.00 63.11 2o5j s PRO 590 Cb -0.18 -2.31 -0.00 0.00 0.02 0.00 0.00 34.50 32.03 2o5j s PRO 590 CO -0.07 -0.98 -0.11 0.14 -0.33 0.00 0.00 177.00 175.66 2o5j s VAL 591 N -1.38 0.87 0.43 3.83 -7.23 -1.26 -3.63 120.40 112.03 2o5j s VAL 591 Ca 0.69 -0.44 -0.26 0.00 -1.81 0.00 0.00 61.98 60.16 2o5j s VAL 591 Cb -0.37 -0.75 -0.09 0.00 0.56 0.00 0.00 36.38 35.74 2o5j s VAL 591 CO 0.44 0.26 1.39 -0.89 -0.31 0.00 0.00 175.10 175.99 2o5j s THR 592 N -0.03 2.24 0.53 5.32 2.01 -1.26 -4.87 115.64 119.58 2o5j s THR 592 Ca 0.00 0.22 -0.19 0.00 0.31 0.00 0.00 61.69 62.04 2o5j s THR 592 Cb -0.07 -3.13 -0.11 0.00 0.01 0.00 0.00 72.50 69.20 2o5j s THR 592 CO 0.00 0.03 0.33 0.59 -0.69 0.00 0.00 174.62 174.89 2o5j n ASN 593 N -0.03 -1.81 -0.21 3.53 4.13 -1.26 -4.43 115.26 115.18 2o5j n ASN 593 Ca 0.04 0.74 -0.02 0.00 1.68 0.00 0.00 54.58 57.02 2o5j n ASN 593 Cb 0.42 -1.07 -0.01 0.00 -1.54 0.00 0.00 39.78 37.59 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 0.51 0.00 0.00 3.52 -0.02 -1.26 -4.09 135.00 133.66 2o5j n PRO 594 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 2o5j n PRO 594 Cb 0.46 -0.07 0.00 0.00 -0.02 0.00 0.00 33.50 33.87 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 0.31 -0.32 2.78 -1.23 0.00 -1.26 -5.08 105.19 100.39 2o5j n GLY 595 Ca 0.03 -0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.88 2o5j n GLY 595 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2o5j s SER 596 N 0.00 1.28 -1.51 1.61 0.01 -1.26 -5.02 113.70 108.82 2o5j s SER 596 Ca 0.00 -0.29 -0.10 0.00 1.31 0.00 0.00 55.95 56.87 2o5j s SER 596 Cb 0.00 0.53 -0.07 0.00 0.21 0.00 0.00 66.02 66.69 2o5j s SER 596 CO 0.00 -0.34 2.76 0.47 0.41 0.00 0.00 173.24 176.54 2o5j n ASP 597 N 5.32 7.66 -4.58 2.44 8.00 -1.26 -4.04 116.55 130.09 2o5j n ASP 597 Ca -0.04 -2.57 -0.34 0.00 0.71 0.00 0.00 54.79 52.55 2o5j n ASP 597 Cb 0.49 -1.50 -0.11 0.00 -0.02 0.00 0.00 41.12 39.97 2o5j n ASP 597 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2o5j s ARG 598 N 2.49 3.31 -0.14 -1.24 0.52 -1.26 -5.05 118.95 117.58 2o5j s ARG 598 Ca 0.63 -0.48 -0.29 0.00 -0.52 0.00 0.00 55.73 55.07 2o5j s ARG 598 Cb 0.17 -2.83 -0.04 0.00 0.52 0.00 0.00 34.95 32.76 2o5j s ARG 598 CO -0.06 0.46 1.72 -2.14 0.02 0.00 0.00 175.30 175.31 2o5j s PRO 599 N -0.24 3.90 -0.03 3.54 0.02 -1.26 -4.19 135.00 136.74 2o5j s PRO 599 Ca 0.05 1.97 -0.33 0.00 0.02 0.00 0.00 61.00 62.71 2o5j s PRO 599 Cb -0.13 -4.06 -0.11 0.00 0.02 0.00 0.00 34.50 30.22 2o5j s PRO 599 CO 0.02 -1.19 1.89 1.28 -0.33 0.00 0.00 177.00 178.68 2o5j n LEU 600 N 8.22 3.67 -4.50 -5.54 4.32 -1.24 -4.72 117.00 117.22 2o5j n LEU 600 Ca 0.19 0.96 -0.42 0.00 -0.02 0.00 0.00 56.01 56.72 2o5j n LEU 600 Cb 0.44 -1.43 -0.09 0.00 -1.62 0.00 0.00 43.42 40.72 2o5j n LEU 600 CO 0.64 0.02 2.05 -1.14 -1.22 0.00 0.00 177.39 177.75 2o5j n ARG 601 N 6.71 0.58 -1.84 3.23 0.63 -1.26 -4.86 116.66 119.85 2o5j n ARG 601 Ca 0.21 0.06 -0.30 0.00 -0.92 0.00 0.00 57.85 56.90 2o5j n ARG 601 Cb 0.33 -2.38 0.06 0.00 0.45 0.00 0.00 32.46 30.92 2o5j n ARG 601 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2o5j s SER 602 N 9.67 5.25 0.19 6.15 1.04 -1.26 -4.60 113.70 130.14 2o5j s SER 602 Ca 1.17 1.13 -0.15 0.00 0.48 0.00 0.00 55.95 58.58 2o5j s SER 602 Cb -0.81 -1.90 0.17 0.00 0.10 0.00 0.00 66.02 63.58 2o5j s SER 602 CO 0.42 -1.47 1.65 -0.07 0.98 0.00 0.00 173.24 174.75 2o5j h LEU 603 N -0.74 -0.48 -0.56 2.42 3.38 -0.53 0.94 115.31 119.74 2o5j h LEU 603 Ca -0.45 0.16 0.11 0.00 0.09 0.00 0.00 57.88 57.79 2o5j h LEU 603 Cb 1.26 0.32 -0.11 0.00 0.09 0.00 0.00 40.66 42.22 2o5j h LEU 603 CO 0.63 -0.17 -0.16 0.74 0.09 0.00 0.00 178.44 179.57 2o5j h THR 604 N 0.00 0.40 -0.35 0.22 2.02 0.23 -0.30 112.91 115.14 2o5j h THR 604 Ca 0.25 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.48 2o5j h THR 604 Cb 0.39 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 2o5j h THR 604 CO -0.54 0.00 0.11 0.44 0.37 0.00 0.00 175.52 175.90 2o5j h ASP 605 N -0.03 0.11 0.09 4.18 3.32 -1.18 -0.96 116.42 121.95 2o5j h ASP 605 Ca 0.27 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.36 2o5j h ASP 605 Cb 0.43 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.02 2o5j h ASP 605 CO -0.59 0.10 0.00 0.00 -1.72 0.00 0.00 179.24 177.03 2o5j n ILE 606 N -5.03 1.00 0.21 0.35 0.13 0.10 -2.03 119.36 114.09 2o5j n ILE 606 Ca 0.01 0.68 0.07 0.00 -1.10 0.00 0.00 62.75 62.41 2o5j n ILE 606 Cb 0.13 -1.67 -0.09 0.00 -0.84 0.00 0.00 39.64 37.16 2o5j n ILE 606 CO 0.00 0.00 0.00 0.18 2.80 0.00 0.00 176.55 179.53 2o5j n LEU 607 N -2.27 0.21 -4.68 9.51 4.77 -0.53 -2.60 117.00 121.41 2o5j n LEU 607 Ca -0.01 -0.17 -0.29 0.00 -0.03 0.00 0.00 56.01 55.51 2o5j n LEU 607 Cb 0.06 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.07 2o5j n LEU 607 CO 0.11 0.05 -0.33 -0.94 -1.33 0.00 0.00 177.39 174.95 2o5j s SER 608 N -3.10 4.97 0.00 -1.43 1.04 -0.48 -4.00 113.70 110.70 2o5j s SER 608 Ca -0.02 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.20 2o5j s SER 608 Cb 0.09 -1.16 0.00 0.00 0.10 0.00 0.00 66.02 65.05 2o5j s SER 608 CO 0.55 0.16 0.00 0.61 0.98 0.00 0.00 173.24 175.54 2o5j n GLY 609 N 0.44 1.85 0.19 7.32 0.00 -1.26 -4.35 105.19 109.37 2o5j n GLY 609 Ca -0.11 -2.09 -0.03 0.00 0.00 0.00 0.00 46.02 43.79 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 0.05 -2.72 1.61 3.64 -1.97 -2.47 116.57 114.71 2o5j h LYS 610 Ca 0.00 -0.00 -0.63 0.00 -1.27 0.00 0.00 60.65 58.74 2o5j h LYS 610 Cb 0.00 -0.01 -0.40 0.00 -0.41 0.00 0.00 32.23 31.41 2o5j h LYS 610 CO 0.00 0.03 -0.43 0.00 -2.27 0.00 0.00 179.45 176.79 2o5j n GLN 611 N -5.28 2.41 -1.68 1.90 10.64 -1.26 -4.80 117.38 119.32 2o5j n GLN 611 Ca 0.04 -4.58 -0.00 0.00 -1.83 0.00 0.00 57.00 50.63 2o5j n GLN 611 Cb 0.25 -2.31 -0.00 0.00 -0.86 0.00 0.00 30.24 27.32 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 1.48 3.37 0.14 2.61 0.00 -0.93 -5.00 105.19 106.86 2o5j n GLY 612 Ca 0.25 -2.18 -0.23 0.00 0.00 0.00 0.00 46.02 43.85 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 0.49 0.00 1.61 9.65 -1.63 -2.24 114.38 122.26 2o5j h ARG 613 Ca -0.01 -0.84 -0.03 0.00 -1.10 0.00 0.00 59.98 58.00 2o5j h ARG 613 Cb 0.02 0.31 -0.00 0.00 -1.39 0.00 0.00 29.97 28.91 2o5j h ARG 613 CO 0.01 1.40 -0.16 0.74 2.80 0.00 0.00 179.97 184.76 2o5j h PHE 614 N 0.13 0.00 0.00 2.20 0.04 -1.86 -1.83 116.94 115.63 2o5j h PHE 614 Ca -0.24 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.36 2o5j h PHE 614 Cb 2.14 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 40.26 2o5j h PHE 614 CO 0.12 0.16 -1.17 -0.09 -0.60 0.00 0.00 178.31 176.73 2o5j h ARG 615 N 0.00 0.00 -0.88 1.51 2.43 -1.81 -3.10 114.38 112.53 2o5j h ARG 615 Ca -0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2o5j h ARG 615 Cb 0.35 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.86 2o5j h ARG 615 CO 0.02 0.43 0.47 0.37 -1.51 0.00 0.00 179.97 179.75 2o5j h GLN 616 N 0.00 1.23 0.04 0.20 5.75 -0.70 -2.21 115.11 119.43 2o5j h GLN 616 Ca -0.12 -0.15 -0.00 0.00 -0.15 0.00 0.00 58.65 58.22 2o5j h GLN 616 Cb 1.60 -0.24 0.00 0.00 1.07 0.00 0.00 27.48 29.91 2o5j h GLN 616 CO 0.06 0.91 -0.02 -0.97 -2.65 0.00 0.00 178.83 176.16 2o5j h ASN 617 N 1.23 -0.05 -0.29 -0.69 -0.00 -1.58 -2.96 115.58 111.24 2o5j h ASN 617 Ca 0.31 -0.62 0.04 0.00 -0.00 0.00 0.00 56.30 56.03 2o5j h ASN 617 Cb 0.05 0.01 -0.04 0.00 -0.00 0.00 0.00 38.32 38.34 2o5j h ASN 617 CO -0.05 0.65 0.05 0.25 -0.00 0.00 0.00 177.43 178.33 2o5j h LEU 618 N -0.80 0.01 -0.54 0.34 6.46 -1.53 -2.55 115.31 116.70 2o5j h LEU 618 Ca -0.01 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 2o5j h LEU 618 Cb 0.67 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.66 2o5j h LEU 618 CO 0.01 0.04 -0.13 0.18 -0.62 0.00 0.00 178.44 177.92 2o5j n LEU 619 N -5.09 0.97 -2.87 2.25 4.77 -0.83 -4.81 117.00 111.39 2o5j n LEU 619 Ca -0.00 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 2o5j n LEU 619 Cb 0.13 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2o5j n LEU 619 CO 0.26 0.17 -0.30 0.61 -1.33 0.00 0.00 177.39 176.80 2o5j n GLY 620 N 1.25 0.00 0.08 -0.72 0.00 -0.96 -4.90 105.19 99.95 2o5j n GLY 620 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 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 3.80 0.05 -3.53 1.61 1.79 -1.90 -3.45 116.57 114.95 2o5j h LYS 621 Ca 0.00 -0.09 -0.50 0.00 -2.18 0.00 0.00 60.65 57.88 2o5j h LYS 621 Cb 0.60 0.03 -0.40 0.00 -1.58 0.00 0.00 32.23 30.89 2o5j h LYS 621 CO 0.00 0.76 -0.76 1.03 -1.08 0.00 0.00 179.45 179.40 2o5j s ARG 622 N -2.63 0.59 0.51 3.15 0.52 -1.26 -5.10 118.95 114.74 2o5j s ARG 622 Ca -0.05 -0.29 -0.22 0.00 -0.52 0.00 0.00 55.73 54.65 2o5j s ARG 622 Cb 0.08 -1.86 -0.06 0.00 0.52 0.00 0.00 34.95 33.63 2o5j s ARG 622 CO 0.82 -0.58 1.28 0.08 0.02 0.00 0.00 175.30 176.92 2o5j s VAL 623 N 1.91 2.52 -0.07 3.52 1.01 -1.26 -5.00 120.40 123.03 2o5j s VAL 623 Ca 0.01 0.39 0.14 0.00 0.00 0.00 0.00 61.98 62.51 2o5j s VAL 623 Cb -0.16 -3.20 -0.22 0.00 0.00 0.00 0.00 36.38 32.80 2o5j s VAL 623 CO -0.08 -0.01 0.62 -0.67 0.00 0.00 0.00 175.10 174.97 2o5j n ASP 624 N -0.80 0.78 -4.04 3.32 2.03 -1.26 -4.51 116.55 112.06 2o5j n ASP 624 Ca 0.09 0.37 -0.34 0.00 0.52 0.00 0.00 54.79 55.43 2o5j n ASP 624 Cb 0.46 0.08 -0.09 0.00 -0.72 0.00 0.00 41.12 40.85 2o5j n ASP 624 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2o5j s TYR 625 N -2.63 3.68 0.19 -0.67 1.51 -1.26 -5.03 117.35 113.14 2o5j s TYR 625 Ca -0.05 -3.06 0.01 0.00 -1.01 0.00 0.00 57.07 52.95 2o5j s TYR 625 Cb 0.08 -3.07 -0.05 0.00 -0.11 0.00 0.00 41.96 38.81 2o5j s TYR 625 CO 0.82 -0.71 0.05 -1.54 -1.11 0.00 0.00 175.55 173.07 2o5j s SER 626 N -0.34 0.91 0.12 2.29 1.04 -1.26 -3.00 113.70 113.45 2o5j s SER 626 Ca 0.24 -1.26 -0.25 0.00 0.48 0.00 0.00 55.95 55.16 2o5j s SER 626 Cb -0.10 0.20 0.07 0.00 0.10 0.00 0.00 66.02 66.29 2o5j s SER 626 CO -0.11 -0.68 0.75 -0.83 0.98 0.00 0.00 173.24 173.35 2o5j s GLY 627 N -3.19 -0.46 -0.26 7.32 0.00 0.16 -4.90 107.32 105.99 2o5j s GLY 627 Ca 0.30 0.50 -0.19 0.00 0.00 0.00 0.00 44.72 45.33 2o5j s GLY 627 CO 0.07 0.16 0.67 1.09 0.00 0.00 0.00 173.10 175.09 2o5j s ARG 628 N -3.53 0.72 0.35 2.90 1.70 -1.26 0.90 118.95 120.74 2o5j s ARG 628 Ca 0.05 1.08 -0.06 0.00 -0.47 0.00 0.00 55.73 56.33 2o5j s ARG 628 Cb -0.02 0.23 0.02 0.00 -0.57 0.00 0.00 34.95 34.61 2o5j s ARG 628 CO -0.07 -0.13 0.55 0.45 -1.08 0.00 0.00 175.30 175.02 2o5j s SER 629 N 1.10 0.67 0.34 -2.89 0.15 -1.18 -5.02 113.70 106.87 2o5j s SER 629 Ca -0.06 -1.38 -0.26 0.00 0.70 0.00 0.00 55.95 54.95 2o5j s SER 629 Cb -0.05 0.71 -0.09 0.00 -1.71 0.00 0.00 66.02 64.87 2o5j s SER 629 CO -0.11 -1.39 1.03 -0.69 1.20 0.00 0.00 173.24 173.27 2o5j s VAL 630 N -2.90 3.82 0.02 4.45 1.01 -1.26 -3.05 120.40 122.48 2o5j s VAL 630 Ca 0.26 1.54 -0.05 0.00 0.00 0.00 0.00 61.98 63.74 2o5j s VAL 630 Cb -0.02 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 2o5j s VAL 630 CO 0.18 0.16 0.24 0.27 0.00 0.00 0.00 175.10 175.95 2o5j s ILE 631 N -1.50 5.34 -0.07 2.22 -4.36 -1.25 -0.77 121.20 120.81 2o5j s ILE 631 Ca 0.52 0.01 -0.11 0.00 -0.26 0.00 0.00 60.65 60.81 2o5j s ILE 631 Cb -0.24 -3.57 0.02 0.00 1.25 0.00 0.00 42.46 39.93 2o5j s ILE 631 CO 0.30 0.31 0.26 -0.69 0.24 0.00 0.00 174.94 175.36 2o5j s VAL 632 N -1.35 0.03 0.28 8.37 1.01 -0.25 -4.78 120.40 123.70 2o5j s VAL 632 Ca 0.29 -0.22 -0.30 0.00 0.00 0.00 0.00 61.98 61.75 2o5j s VAL 632 Cb -0.13 -0.45 -0.13 0.00 0.00 0.00 0.00 36.38 35.67 2o5j s VAL 632 CO 0.18 -0.12 1.42 0.55 0.00 0.00 0.00 175.10 177.13 2o5j n VAL 633 N 2.31 1.26 -3.15 2.92 3.14 -1.26 -1.92 118.33 121.62 2o5j n VAL 633 Ca -0.16 -0.31 -0.24 0.00 -2.96 0.00 0.00 64.34 60.66 2o5j n VAL 633 Cb 0.57 -1.61 -0.05 0.00 -1.06 0.00 0.00 33.84 31.69 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 1.76 4.53 0.28 7.55 0.00 -0.41 -4.76 105.19 114.13 2o5j n GLY 634 Ca 0.09 -2.34 0.11 0.00 0.00 0.00 0.00 46.02 43.88 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 0.39 -0.06 0.17 1.61 -0.02 -1.26 -1.04 135.00 134.78 2o5j n PRO 635 Ca 0.28 1.19 0.05 0.00 -2.02 0.00 0.00 63.50 63.00 2o5j n PRO 635 Cb 0.48 -1.87 0.17 0.00 -0.02 0.00 0.00 33.50 32.25 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 -6.82 -0.52 1.08 -1.97 -3.46 115.11 103.42 2o5j h GLN 636 Ca 0.46 0.00 -0.57 0.00 -1.45 0.00 0.00 58.65 57.09 2o5j h GLN 636 Cb 0.92 0.00 0.16 0.00 -0.05 0.00 0.00 27.48 28.51 2o5j h GLN 636 CO -0.75 0.40 0.18 -0.11 -0.95 0.00 0.00 178.83 177.60 2o5j n LEU 637 N -3.30 3.70 -4.76 1.46 7.94 -0.21 -5.01 117.00 116.82 2o5j n LEU 637 Ca 0.01 0.86 -0.30 0.00 -1.11 0.00 0.00 56.01 55.47 2o5j n LEU 637 Cb 0.63 -1.40 -0.07 0.00 0.53 0.00 0.00 43.42 43.11 2o5j n LEU 637 CO 0.38 -1.67 -0.27 -0.54 -1.11 0.00 0.00 177.39 174.18 2o5j s LYS 638 N -2.65 2.83 0.38 1.96 -0.14 -1.26 -4.92 119.74 115.93 2o5j s LYS 638 Ca 0.73 -0.74 0.27 0.00 -1.36 0.00 0.00 55.97 54.88 2o5j s LYS 638 Cb -0.44 -2.69 1.30 0.00 -1.68 0.00 0.00 37.83 34.33 2o5j s LYS 638 CO 0.49 0.55 1.38 1.28 -0.76 0.00 0.00 175.35 178.29 2o5j n LEU 639 N 0.37 0.21 -0.32 3.17 4.77 -1.26 0.83 117.00 124.76 2o5j n LEU 639 Ca -0.09 1.27 0.01 0.00 -0.03 0.00 0.00 56.01 57.17 2o5j n LEU 639 Cb 0.52 -0.62 0.18 0.00 -2.33 0.00 0.00 43.42 41.17 2o5j n LEU 639 CO 0.43 -1.39 1.27 -0.74 -1.33 0.00 0.00 177.39 175.64 2o5j h HIS 640 N 0.00 1.14 -0.34 -1.77 2.76 -1.94 -3.42 115.15 111.58 2o5j h HIS 640 Ca 0.77 0.03 -0.67 0.00 -2.20 0.00 0.00 60.37 58.31 2o5j h HIS 640 Cb 2.43 -0.38 -0.12 0.00 1.55 0.00 0.00 27.41 30.89 2o5j h HIS 640 CO -0.01 0.67 -0.48 -0.65 -1.30 0.00 0.00 177.93 176.16 2o5j s GLN 641 N -6.00 2.21 -0.01 5.26 -0.21 0.24 -0.94 119.66 120.22 2o5j s GLN 641 Ca -0.12 -2.35 -0.16 0.00 0.02 0.00 0.00 55.36 52.74 2o5j s GLN 641 Cb 0.19 -1.62 0.03 0.00 1.00 0.00 0.00 33.01 32.61 2o5j s GLN 641 CO 0.81 -0.42 0.34 0.00 -2.12 0.00 0.00 175.29 173.90 2o5j s GLY 643 N -1.38 1.55 -0.16 0.00 0.00 0.49 -0.81 107.32 107.01 2o5j s GLY 643 Ca -0.13 -0.72 -0.00 0.00 0.00 0.00 0.00 44.72 43.87 2o5j s GLY 643 CO 0.04 1.93 -0.13 -2.27 0.00 0.00 0.00 173.10 172.68 2o5j s LEU 644 N 3.48 2.61 0.12 0.66 2.96 -1.17 0.29 118.68 127.63 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 -0.11 -1.60 -0.13 0.00 0.50 0.00 0.00 46.19 44.85 2o5j s LEU 644 CO 0.22 0.09 1.69 -2.65 -1.32 0.00 0.00 176.35 174.38 2o5j n PRO 645 N 4.02 2.35 -0.27 0.98 -0.02 -1.26 -1.39 135.00 139.40 2o5j n PRO 645 Ca -0.19 0.85 -0.02 0.00 -2.02 0.00 0.00 63.50 62.13 2o5j n PRO 645 Cb 0.52 -2.66 0.10 0.00 -0.02 0.00 0.00 33.50 31.44 2o5j n PRO 645 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2o5j h LYS 646 N 6.98 0.86 -0.78 -0.52 1.57 -1.24 0.17 116.57 123.61 2o5j h LYS 646 Ca -0.45 -0.05 0.14 0.00 -1.87 0.00 0.00 60.65 58.41 2o5j h LYS 646 Cb 1.24 -0.20 -0.05 0.00 0.08 0.00 0.00 32.23 33.30 2o5j h LYS 646 CO 0.92 0.57 0.52 0.00 -0.57 0.00 0.00 179.45 180.88 2o5j h ARG 647 N 0.89 0.50 0.17 3.15 -0.00 -1.86 1.00 114.38 118.23 2o5j h ARG 647 Ca 0.32 -0.03 -0.31 0.00 -0.50 0.00 0.00 59.98 59.46 2o5j h ARG 647 Cb 0.09 -0.11 0.03 0.00 0.00 0.00 0.00 29.97 29.98 2o5j h ARG 647 CO -0.14 0.33 -1.32 0.52 0.00 0.00 0.00 179.97 179.35 2o5j h MET 648 N 0.51 0.54 -0.31 0.04 2.86 -1.40 -3.28 114.93 113.89 2o5j h MET 648 Ca 0.38 -0.81 0.03 0.00 -2.06 0.00 0.00 59.70 57.24 2o5j h MET 648 Cb 0.76 0.28 -0.02 0.00 0.06 0.00 0.00 31.60 32.68 2o5j h MET 648 CO -0.14 1.37 0.21 0.00 1.06 0.00 0.00 176.91 179.41 2o5j h ALA 649 N 0.30 1.93 -0.18 6.32 0.00 0.11 -1.93 119.26 125.80 2o5j h ALA 649 Ca -0.20 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2o5j h ALA 649 Cb 2.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.71 2o5j h ALA 649 CO 0.25 0.03 0.07 1.25 0.00 0.00 0.00 179.25 180.85 2o5j h LEU 650 N 0.29 0.25 -0.09 0.00 5.85 -0.95 0.91 115.31 121.57 2o5j h LEU 650 Ca 0.13 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 2o5j h LEU 650 Cb 0.15 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 2o5j h LEU 650 CO -0.03 0.34 -0.09 -0.33 -0.34 0.00 0.00 178.44 178.00 2o5j h GLU 651 N 0.14 0.21 0.31 1.25 4.39 -1.53 -1.91 114.58 117.44 2o5j h GLU 651 Ca 0.06 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.65 2o5j h GLU 651 Cb 0.17 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 2o5j h GLU 651 CO -0.01 0.64 -0.30 -0.07 -1.16 0.00 0.00 179.01 178.11 2o5j h LEU 652 N -0.20 -0.81 -2.98 1.33 4.07 -1.35 -2.62 115.31 112.74 2o5j h LEU 652 Ca 0.01 0.07 -0.25 0.00 0.08 0.00 0.00 57.88 57.80 2o5j h LEU 652 Cb 0.60 0.27 -0.15 0.00 1.08 0.00 0.00 40.66 42.47 2o5j h LEU 652 CO 0.02 -0.43 0.32 0.49 -1.08 0.00 0.00 178.44 177.76 2o5j n PHE 653 N -5.42 1.56 0.27 1.13 3.01 0.31 -4.63 117.46 113.69 2o5j n PHE 653 Ca -0.09 -1.14 -0.15 0.00 1.01 0.00 0.00 57.45 57.08 2o5j n PHE 653 Cb 0.32 -0.59 -0.08 0.00 -0.01 0.00 0.00 39.48 39.12 2o5j n PHE 653 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 2o5j h LYS 654 N 0.64 -0.84 -0.47 -1.08 3.64 -0.94 -0.18 116.57 117.33 2o5j h LYS 654 Ca 0.31 0.06 0.07 0.00 -1.27 0.00 0.00 60.65 59.81 2o5j h LYS 654 Cb 1.92 0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 33.87 2o5j h LYS 654 CO 0.55 -0.56 0.14 -1.35 -2.27 0.00 0.00 179.45 175.96 2o5j h PRO 655 N -0.87 0.29 -0.17 1.90 0.11 -1.85 0.12 132.00 131.53 2o5j h PRO 655 Ca -0.06 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.08 2o5j h PRO 655 Cb 0.74 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 2o5j h PRO 655 CO -0.01 0.19 0.14 0.74 -0.21 0.00 0.00 178.00 178.85 2o5j h PHE 656 N 0.30 0.00 0.08 0.65 -1.00 -1.88 -2.37 116.94 112.72 2o5j h PHE 656 Ca 0.23 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.90 2o5j h PHE 656 Cb 0.26 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.84 2o5j h PHE 656 CO -0.18 0.00 -0.47 1.25 -1.61 0.00 0.00 178.31 177.29 2o5j h LEU 657 N 0.00 0.26 -0.65 1.54 5.85 0.88 -3.20 115.31 119.99 2o5j h LEU 657 Ca 0.08 -0.97 0.12 0.00 0.84 0.00 0.00 57.88 57.95 2o5j h LEU 657 Cb 0.35 -0.08 -0.12 0.00 0.37 0.00 0.00 40.66 41.17 2o5j h LEU 657 CO -0.00 1.23 -0.26 -0.07 -0.34 0.00 0.00 178.44 178.99 2o5j h LEU 658 N -0.65 -0.93 -0.21 2.25 3.38 -0.34 0.32 115.31 119.12 2o5j h LEU 658 Ca -0.09 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2o5j h LEU 658 Cb 1.36 0.51 -0.01 0.00 0.09 0.00 0.00 40.66 42.61 2o5j h LEU 658 CO 0.08 -0.27 0.13 0.50 0.09 0.00 0.00 178.44 178.97 2o5j h LYS 659 N -0.09 0.28 -0.49 1.13 1.63 -1.66 -2.33 116.57 115.05 2o5j h LYS 659 Ca 0.28 -0.02 0.11 0.00 -0.85 0.00 0.00 60.65 60.17 2o5j h LYS 659 Cb 0.54 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.08 2o5j h LYS 659 CO -0.70 0.20 0.34 -0.22 -3.45 0.00 0.00 179.45 175.62 2o5j h LYS 660 N 0.27 0.18 -0.54 1.90 1.63 -0.91 -0.06 116.57 119.04 2o5j h LYS 660 Ca 0.08 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.83 2o5j h LYS 660 Cb -0.01 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 2o5j h LYS 660 CO -0.02 0.12 0.21 0.52 -3.45 0.00 0.00 179.45 176.84 2o5j h MET 661 N 0.19 0.82 -0.20 1.90 2.86 0.07 -2.83 114.93 117.73 2o5j h MET 661 Ca 0.23 -0.15 -0.11 0.00 -2.06 0.00 0.00 59.70 57.60 2o5j h MET 661 Cb 0.65 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 2o5j h MET 661 CO -0.04 0.71 -0.35 1.49 1.06 0.00 0.00 176.91 179.78 2o5j h GLU 662 N 0.74 0.44 0.00 1.72 4.81 -0.86 -2.58 114.58 118.84 2o5j h GLU 662 Ca 0.18 -0.20 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 2o5j h GLU 662 Cb 0.21 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 2o5j h GLU 662 CO -0.01 0.73 -0.04 0.93 -0.73 0.00 0.00 179.01 179.89 2o5j h GLU 663 N 0.37 0.00 -5.80 1.92 5.08 -1.12 -3.43 114.58 111.61 2o5j h GLU 663 Ca 0.04 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.81 2o5j h GLU 663 Cb 0.80 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.98 2o5j h GLU 663 CO 0.06 0.04 -0.37 0.15 -1.00 0.00 0.00 179.01 177.89 2o5j s LYS 664 N -4.20 2.25 0.00 2.33 1.02 -0.98 -5.05 119.74 115.12 2o5j s LYS 664 Ca -0.03 -2.04 0.29 0.00 0.02 0.00 0.00 55.97 54.21 2o5j s LYS 664 Cb 0.13 -1.99 1.32 0.00 -0.52 0.00 0.00 37.83 36.76 2o5j s LYS 664 CO 0.51 -0.48 1.94 0.41 -0.92 0.00 0.00 175.35 176.82 2o5j n GLY 665 N -1.59 -1.31 0.39 -3.33 0.00 -1.26 -4.08 105.19 94.02 2o5j n GLY 665 Ca -0.05 -0.16 0.18 0.00 0.00 0.00 0.00 46.02 45.99 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 0.08 0.73 -3.23 -0.61 2.04 -1.93 -3.42 117.51 111.18 2o5j h ILE 666 Ca 0.00 -0.13 -0.16 0.00 1.00 0.00 0.00 64.86 65.57 2o5j h ILE 666 Cb 0.39 0.33 -0.25 0.00 -0.74 0.00 0.00 36.82 36.55 2o5j h ILE 666 CO 0.00 0.07 -0.45 0.00 0.00 0.00 0.00 178.15 177.77 2o5j s ALA 667 N -5.37 -0.54 -0.00 1.87 0.00 -1.21 -5.00 121.76 111.50 2o5j s ALA 667 Ca -0.08 0.50 -0.25 0.00 0.00 0.00 0.00 51.96 52.14 2o5j s ALA 667 Cb 0.22 -0.27 -0.19 0.00 0.00 0.00 0.00 23.12 22.88 2o5j s ALA 667 CO 0.77 -0.13 1.31 -1.35 0.00 0.00 0.00 175.76 176.36 2o5j h PRO 668 N 5.43 0.07 -4.54 0.00 0.11 -1.89 -3.35 132.00 127.83 2o5j h PRO 668 Ca -0.27 -0.04 -0.35 0.00 0.11 0.00 0.00 66.00 65.46 2o5j h PRO 668 Cb 1.19 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.19 2o5j h PRO 668 CO 0.37 0.51 -0.40 0.54 -0.21 0.00 0.00 178.00 178.81 2o5j s ASN 669 N -5.75 1.07 0.02 -2.05 4.22 -1.26 -4.87 114.94 106.33 2o5j s ASN 669 Ca -0.15 -1.57 -0.08 0.00 -2.14 0.00 0.00 52.86 48.92 2o5j s ASN 669 Cb 0.03 0.56 -0.03 0.00 1.28 0.00 0.00 41.25 43.08 2o5j s ASN 669 CO 0.69 -1.10 1.13 0.58 -2.04 0.00 0.00 177.10 176.36 2o5j h VAL 670 N 2.22 0.00 -0.98 3.54 2.07 -1.92 0.48 116.25 121.66 2o5j h VAL 670 Ca -0.28 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.48 2o5j h VAL 670 Cb 1.24 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.93 2o5j h VAL 670 CO 0.40 0.00 0.65 0.11 0.02 0.00 0.00 177.57 178.75 2o5j h LYS 671 N -0.18 0.33 -0.06 1.57 1.57 -1.98 0.26 116.57 118.09 2o5j h LYS 671 Ca -0.00 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 2o5j h LYS 671 Cb 0.18 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2o5j h LYS 671 CO -0.06 0.22 -0.02 0.00 -0.57 0.00 0.00 179.45 179.02 2o5j h ALA 672 N 1.59 0.08 -0.27 3.86 0.00 -1.83 -2.15 119.26 120.55 2o5j h ALA 672 Ca 0.52 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2o5j h ALA 672 Cb 1.43 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2o5j h ALA 672 CO -0.20 -0.20 0.17 0.00 0.00 0.00 0.00 179.25 179.02 2o5j h ALA 673 N 0.66 1.80 0.28 0.00 0.00 0.28 -0.75 119.26 121.53 2o5j h ALA 673 Ca 0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2o5j h ALA 673 Cb 0.41 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2o5j h ALA 673 CO 0.01 0.18 -0.14 0.00 0.00 0.00 0.00 179.25 179.30 2o5j h ARG 674 N 0.36 -0.37 -0.62 0.00 3.08 -0.50 -3.14 114.38 113.19 2o5j h ARG 674 Ca 0.10 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.20 2o5j h ARG 674 Cb -0.04 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 2o5j h ARG 674 CO -0.02 -0.03 0.41 0.00 -1.07 0.00 0.00 179.97 179.26 2o5j h ARG 675 N -0.77 0.74 -0.22 0.04 3.08 -1.15 -0.89 114.38 115.20 2o5j h ARG 675 Ca -0.04 -0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.03 2o5j h ARG 675 Cb 0.51 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 2o5j h ARG 675 CO 0.06 0.49 0.23 0.52 -1.07 0.00 0.00 179.97 180.20 2o5j h MET 676 N 0.76 0.00 -0.04 0.04 2.86 -1.11 -2.30 114.93 115.14 2o5j h MET 676 Ca 0.25 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 2o5j h MET 676 Cb 0.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.70 2o5j h MET 676 CO -0.06 0.00 0.00 1.28 1.06 0.00 0.00 176.91 179.19 2o5j n LEU 677 N -3.84 1.67 0.20 1.22 4.77 -0.43 -4.20 117.00 116.38 2o5j n LEU 677 Ca 0.02 -1.18 0.14 0.00 -0.03 0.00 0.00 56.01 54.97 2o5j n LEU 677 Cb 0.36 -0.02 0.63 0.00 -2.33 0.00 0.00 43.42 42.07 2o5j n LEU 677 CO 0.28 0.37 0.93 1.05 -1.33 0.00 0.00 177.39 178.68 2o5j h GLU 678 N 1.14 0.00 -6.50 3.23 4.11 -0.70 -3.42 114.58 112.45 2o5j h GLU 678 Ca 0.00 0.00 -0.66 0.00 0.07 0.00 0.00 59.36 58.77 2o5j h GLU 678 Cb 0.31 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 29.29 2o5j h GLU 678 CO 0.00 0.00 -0.87 1.03 0.07 0.00 0.00 179.01 179.24 2o5j s ARG 679 N -3.53 1.78 0.27 1.06 0.52 -1.26 -5.05 118.95 112.74 2o5j s ARG 679 Ca 0.02 -0.99 0.03 0.00 -0.52 0.00 0.00 55.73 54.26 2o5j s ARG 679 Cb 0.09 -1.86 0.36 0.00 0.52 0.00 0.00 34.95 34.06 2o5j s ARG 679 CO 0.41 0.49 1.67 1.96 0.02 0.00 0.00 175.30 179.85 2o5j h GLN 680 N 5.07 0.41 -0.01 3.54 7.50 -1.93 -2.92 115.11 126.77 2o5j h GLN 680 Ca -0.44 -0.19 0.00 0.00 0.50 0.00 0.00 58.65 58.52 2o5j h GLN 680 Cb 1.14 -0.01 0.00 0.00 0.05 0.00 0.00 27.48 28.66 2o5j h GLN 680 CO 0.45 0.72 0.00 -2.13 -1.50 0.00 0.00 178.83 176.37 2o5j n ARG 681 N -4.05 1.02 0.00 1.46 0.63 -1.26 -3.47 116.66 110.99 2o5j n ARG 681 Ca -0.01 -0.03 0.08 0.00 -0.92 0.00 0.00 57.85 56.97 2o5j n ARG 681 Cb 0.48 -1.20 0.02 0.00 0.45 0.00 0.00 32.46 32.21 2o5j n ARG 681 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2o5j n ASP 682 N -0.67 1.87 -4.65 6.15 8.00 -1.10 -4.96 116.55 121.19 2o5j n ASP 682 Ca 0.09 -1.43 -0.43 0.00 0.71 0.00 0.00 54.79 53.73 2o5j n ASP 682 Cb 0.05 0.31 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 2o5j n ASP 682 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2o5j s ILE 683 N -1.70 4.49 0.38 0.53 1.09 -1.23 -4.89 121.20 119.87 2o5j s ILE 683 Ca 0.15 1.77 -0.24 0.00 -1.10 0.00 0.00 60.65 61.23 2o5j s ILE 683 Cb 0.13 -4.24 -0.09 0.00 -1.06 0.00 0.00 42.46 37.20 2o5j s ILE 683 CO 0.33 -0.27 1.03 -0.54 -0.10 0.00 0.00 174.94 175.39 2o5j s LYS 684 N 3.48 4.25 0.66 2.79 1.02 -1.26 -4.90 119.74 125.78 2o5j s LYS 684 Ca 0.48 1.47 0.28 0.00 0.02 0.00 0.00 55.97 58.22 2o5j s LYS 684 Cb -0.16 -2.58 1.52 0.00 -0.52 0.00 0.00 37.83 36.08 2o5j s LYS 684 CO 0.12 -0.05 1.86 -0.44 -0.92 0.00 0.00 175.35 175.92 2o5j h ASP 685 N 2.62 0.00 -0.63 2.83 3.32 -2.03 0.92 116.42 123.46 2o5j h ASP 685 Ca -0.48 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.58 2o5j h ASP 685 Cb 1.21 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.73 2o5j h ASP 685 CO 0.63 0.00 0.42 -0.33 -1.72 0.00 0.00 179.24 178.23 2o5j h GLU 686 N 0.00 0.81 -0.49 3.56 5.08 -2.01 -2.54 114.58 118.98 2o5j h GLU 686 Ca 0.03 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 2o5j h GLU 686 Cb 0.81 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 2o5j h GLU 686 CO -0.00 0.53 0.29 0.28 -1.00 0.00 0.00 179.01 179.11 2o5j h VAL 687 N 0.83 1.04 -0.49 3.13 2.07 -1.18 -2.24 116.25 119.42 2o5j h VAL 687 Ca 0.23 -0.20 0.08 0.00 0.82 0.00 0.00 66.70 67.64 2o5j h VAL 687 Cb -0.07 0.42 -0.07 0.00 -1.52 0.00 0.00 31.29 30.05 2o5j h VAL 687 CO -0.05 0.10 0.11 -0.50 0.02 0.00 0.00 177.57 177.25 2o5j h TRP 688 N 0.58 0.18 -0.82 1.57 -0.00 -1.61 -0.22 115.95 115.63 2o5j h TRP 688 Ca 0.20 0.03 0.07 0.00 -0.00 0.00 0.00 58.89 59.19 2o5j h TRP 688 Cb 0.03 -0.01 -0.05 0.00 -0.00 0.00 0.00 29.16 29.13 2o5j h TRP 688 CO -0.07 0.01 0.53 -0.44 -0.00 0.00 0.00 178.44 178.48 2o5j h ASP 689 N 0.25 0.78 0.23 -3.49 3.32 -1.35 -0.05 116.42 116.10 2o5j h ASP 689 Ca 0.24 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 2o5j h ASP 689 Cb 0.31 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.70 2o5j h ASP 689 CO -0.30 0.49 -0.11 0.00 -1.72 0.00 0.00 179.24 177.60 2o5j h ALA 690 N 1.56 -0.30 -0.55 3.45 0.00 -0.60 -2.30 119.26 120.51 2o5j h ALA 690 Ca 0.36 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.12 2o5j h ALA 690 Cb 0.26 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 2o5j h ALA 690 CO -0.13 -0.51 0.32 1.25 0.00 0.00 0.00 179.25 180.18 2o5j h LEU 691 N -0.63 0.49 -1.75 0.00 5.85 -0.77 -0.15 115.31 118.35 2o5j h LEU 691 Ca -0.03 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.80 2o5j h LEU 691 Cb 0.45 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 2o5j h LEU 691 CO 0.05 0.34 0.35 -0.08 -0.34 0.00 0.00 178.44 178.76 2o5j h GLU 692 N 0.62 0.28 0.07 1.25 4.57 -1.02 -1.28 114.58 119.06 2o5j h GLU 692 Ca 0.23 -0.02 -0.24 0.00 -1.18 0.00 0.00 59.36 58.15 2o5j h GLU 692 Cb 0.07 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 2o5j h GLU 692 CO -0.12 0.18 -1.11 1.49 -1.18 0.00 0.00 179.01 178.27 2o5j h GLU 693 N 0.28 0.20 -0.24 1.92 4.81 -0.64 -3.24 114.58 117.67 2o5j h GLU 693 Ca 0.24 -0.31 -0.17 0.00 -0.13 0.00 0.00 59.36 58.98 2o5j h GLU 693 Cb 0.56 0.11 -0.00 0.00 0.63 0.00 0.00 28.75 30.05 2o5j h GLU 693 CO -0.05 1.12 -0.55 0.28 -0.73 0.00 0.00 179.01 179.08 2o5j h VAL 694 N 0.07 1.30 -0.06 0.32 2.07 0.05 -3.07 116.25 116.93 2o5j h VAL 694 Ca -0.09 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 65.67 2o5j h VAL 694 Cb 1.83 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 33.28 2o5j h VAL 694 CO 0.17 0.56 0.00 0.00 0.02 0.00 0.00 177.57 178.33 2o5j n ILE 695 N -3.98 0.06 -0.05 4.57 3.06 -0.75 -4.68 119.36 117.59 2o5j n ILE 695 Ca -0.04 -0.21 -0.01 0.00 -2.50 0.00 0.00 62.75 59.99 2o5j n ILE 695 Cb 0.62 0.22 -0.01 0.00 0.54 0.00 0.00 39.64 41.01 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 -0.07 -0.05 -0.77 9.51 -0.00 -1.16 -2.25 115.22 120.43 2o5j n HIS 696 Ca 0.18 0.14 0.02 0.00 -0.00 0.00 0.00 57.72 58.07 2o5j n HIS 696 Cb 0.28 -0.30 0.03 0.00 -0.00 0.00 0.00 29.99 30.00 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 -1.03 1.71 3.86 1.57 0.00 -1.26 -5.04 105.19 104.99 2o5j n GLY 697 Ca 0.00 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.08 3.78 0.22 1.61 -0.14 -0.96 -5.08 119.74 118.10 2o5j s LYS 698 Ca 0.08 0.83 0.08 0.00 -1.36 0.00 0.00 55.97 55.59 2o5j s LYS 698 Cb 0.07 -2.13 -0.05 0.00 -1.68 0.00 0.00 37.83 34.04 2o5j s LYS 698 CO 0.01 -0.39 -0.13 0.14 -0.76 0.00 0.00 175.35 174.22 2o5j s VAL 699 N -2.86 1.72 0.26 3.17 -7.23 -1.26 -4.41 120.40 109.80 2o5j s VAL 699 Ca 0.57 -2.20 0.08 0.00 -1.81 0.00 0.00 61.98 58.62 2o5j s VAL 699 Cb -0.10 -2.12 -0.05 0.00 0.56 0.00 0.00 36.38 34.66 2o5j s VAL 699 CO 0.41 -0.54 -0.11 0.68 -0.31 0.00 0.00 175.10 175.24 2o5j s VAL 700 N -2.98 1.85 -0.05 1.32 -7.23 -0.68 -4.28 120.40 108.36 2o5j s VAL 700 Ca 0.24 -2.20 0.00 0.00 -1.81 0.00 0.00 61.98 58.21 2o5j s VAL 700 Cb 0.00 -2.32 -0.03 0.00 0.56 0.00 0.00 36.38 34.59 2o5j s VAL 700 CO 0.08 -0.40 -0.03 -0.76 -0.31 0.00 0.00 175.10 173.68 2o5j s LEU 701 N -3.43 3.39 -0.06 1.32 1.02 -0.63 -0.98 118.68 119.32 2o5j s LEU 701 Ca 0.28 0.02 0.02 0.00 0.02 0.00 0.00 54.13 54.47 2o5j s LEU 701 Cb 0.01 -1.83 -0.03 0.00 0.02 0.00 0.00 46.19 44.36 2o5j s LEU 701 CO 0.11 0.34 -0.11 -0.76 0.02 0.00 0.00 176.35 175.95 2o5j s LEU 702 N -1.10 2.94 0.09 1.79 1.02 0.02 -0.70 118.68 122.74 2o5j s LEU 702 Ca 0.15 -0.12 0.07 0.00 0.02 0.00 0.00 54.13 54.26 2o5j s LEU 702 Cb -0.11 -1.62 -0.03 0.00 0.02 0.00 0.00 46.19 44.44 2o5j s LEU 702 CO 0.05 0.35 -0.19 0.21 0.02 0.00 0.00 176.35 176.78 2o5j s ASN 703 N -0.72 2.30 0.33 2.29 3.04 -0.80 -2.66 114.94 118.72 2o5j s ASN 703 Ca 0.11 -0.66 0.08 0.00 0.04 0.00 0.00 52.86 52.43 2o5j s ASN 703 Cb -0.11 -0.12 -0.04 0.00 -1.54 0.00 0.00 41.25 39.44 2o5j s ASN 703 CO 0.01 0.03 0.15 -0.60 -3.04 0.00 0.00 177.10 173.65 2o5j s ARG 704 N -1.82 2.41 0.00 0.43 6.06 -1.22 -1.16 118.95 123.66 2o5j s ARG 704 Ca 0.04 -1.50 0.00 0.00 -2.50 0.00 0.00 55.73 51.77 2o5j s ARG 704 Cb -0.10 -2.21 0.00 0.00 0.06 0.00 0.00 34.95 32.70 2o5j s ARG 704 CO 0.04 0.13 0.01 0.00 -2.50 0.00 0.00 175.30 172.98 2o5j n ALA 705 N -1.15 0.00 -2.62 6.12 0.00 -1.26 -3.92 120.51 117.68 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 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.02 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 -0.01 3.97 -0.90 0.00 0.02 -1.26 -4.92 135.00 131.91 2o5j s PRO 706 Ca 0.00 0.70 -0.24 0.00 0.02 0.00 0.00 61.00 61.48 2o5j s PRO 706 Cb 0.00 -3.74 0.00 0.00 0.02 0.00 0.00 34.50 30.78 2o5j s PRO 706 CO 0.00 -0.76 1.66 0.99 -0.33 0.00 0.00 177.00 178.56 2o5j s THR 707 N 3.18 3.66 -0.13 0.99 2.01 -1.25 -4.81 115.64 119.28 2o5j s THR 707 Ca 0.36 -0.37 -0.25 0.00 0.31 0.00 0.00 61.69 61.74 2o5j s THR 707 Cb -0.13 -4.53 -0.26 0.00 0.01 0.00 0.00 72.50 67.58 2o5j s THR 707 CO 0.14 -1.45 0.70 -0.07 -0.69 0.00 0.00 174.62 173.25 2o5j h LEU 708 N 15.10 0.13 0.00 4.42 3.38 -1.91 -3.48 115.31 132.94 2o5j h LEU 708 Ca 0.05 -0.91 -0.59 0.00 0.09 0.00 0.00 57.88 56.52 2o5j h LEU 708 Cb 1.03 -0.04 -0.11 0.00 0.09 0.00 0.00 40.66 41.63 2o5j h LEU 708 CO 1.31 1.20 -0.43 0.00 0.09 0.00 0.00 178.44 180.60 2o5j n HIS 709 N -4.43 0.97 -0.08 1.13 1.44 -1.26 -4.58 115.22 108.40 2o5j n HIS 709 Ca -0.15 -2.28 0.05 0.00 -2.01 0.00 0.00 57.72 53.32 2o5j n HIS 709 Cb 0.61 -0.27 0.38 0.00 0.12 0.00 0.00 29.99 30.84 2o5j n HIS 709 CO 0.00 0.00 0.00 -0.09 -2.81 0.00 0.00 176.34 173.44 2o5j h ARG 710 N 0.00 0.65 -0.07 -1.40 2.43 -1.93 0.57 114.38 114.62 2o5j h ARG 710 Ca -0.37 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 2o5j h ARG 710 Cb 1.15 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 2o5j h ARG 710 CO 0.62 0.43 0.00 1.28 -1.51 0.00 0.00 179.97 180.78 2o5j n LEU 711 N -4.46 0.07 0.17 3.80 4.77 -1.26 -2.29 117.00 117.79 2o5j n LEU 711 Ca 0.06 -0.03 0.13 0.00 -0.03 0.00 0.00 56.01 56.14 2o5j n LEU 711 Cb 0.12 -0.03 0.59 0.00 -2.33 0.00 0.00 43.42 41.76 2o5j n LEU 711 CO 0.35 0.02 0.89 1.23 -1.33 0.00 0.00 177.39 178.54 2o5j h GLY 712 N 4.48 0.00 -6.23 -0.72 0.00 -0.19 -3.38 103.07 97.03 2o5j h GLY 712 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 2o5j h GLY 712 CO 0.00 0.00 -0.69 -0.42 0.00 0.00 0.00 176.54 175.43 2o5j s ILE 713 N -3.47 -0.04 0.07 2.60 1.01 -0.97 -3.38 121.20 117.02 2o5j s ILE 713 Ca 0.01 0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.84 2o5j s ILE 713 Cb 0.09 -0.11 -0.03 0.00 0.01 0.00 0.00 42.46 42.41 2o5j s ILE 713 CO 0.36 0.07 -0.07 -1.10 0.00 0.00 0.00 174.94 174.19 2o5j s GLN 714 N 0.85 0.69 -0.13 2.79 -1.52 -1.09 -4.94 119.66 116.32 2o5j s GLN 714 Ca -0.07 -1.07 -0.05 0.00 -1.95 0.00 0.00 55.36 52.23 2o5j s GLN 714 Cb -0.10 -0.24 -0.04 0.00 -0.22 0.00 0.00 33.01 32.42 2o5j s GLN 714 CO -0.03 0.01 0.05 0.00 -0.25 0.00 0.00 175.29 175.07 2o5j s ALA 715 N -2.59 3.43 0.17 6.09 0.00 -0.11 -0.80 121.76 127.95 2o5j s ALA 715 Ca 0.02 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.22 2o5j s ALA 715 Cb -0.02 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.34 2o5j s ALA 715 CO -0.02 0.45 0.06 -0.06 0.00 0.00 0.00 175.76 176.18 2o5j s PHE 716 N -0.45 1.11 -0.39 0.00 0.40 -0.15 -2.92 117.98 115.58 2o5j s PHE 716 Ca 0.09 -1.20 -0.22 0.00 -0.60 0.00 0.00 56.93 55.00 2o5j s PHE 716 Cb -0.12 -0.62 0.01 0.00 0.51 0.00 0.00 43.02 42.81 2o5j s PHE 716 CO 0.02 -0.43 0.74 -1.14 0.70 0.00 0.00 175.22 175.11 2o5j s GLN 717 N -4.03 3.60 0.20 0.44 2.00 -0.12 -1.68 119.66 120.07 2o5j s GLN 717 Ca 0.29 0.08 -0.30 0.00 -2.00 0.00 0.00 55.36 53.42 2o5j s GLN 717 Cb 0.07 -3.86 -0.09 0.00 0.80 0.00 0.00 33.01 29.93 2o5j s GLN 717 CO 0.06 -0.91 1.39 -2.14 -0.50 0.00 0.00 175.29 173.19 2o5j s PRO 718 N 3.04 4.32 -0.56 1.67 0.02 -1.26 -1.30 135.00 140.93 2o5j s PRO 718 Ca 0.29 2.17 -0.01 0.00 0.02 0.00 0.00 61.00 63.47 2o5j s PRO 718 Cb -0.13 -3.17 0.15 0.00 0.02 0.00 0.00 34.50 31.36 2o5j s PRO 718 CO 0.18 -0.37 0.35 0.08 -0.33 0.00 0.00 177.00 176.91 2o5j s VAL 719 N 0.32 3.32 0.04 3.83 1.01 0.01 -4.91 120.40 124.02 2o5j s VAL 719 Ca 0.60 -2.93 -0.38 0.00 0.00 0.00 0.00 61.98 59.26 2o5j s VAL 719 Cb -0.39 -3.22 -0.18 0.00 0.00 0.00 0.00 36.38 32.59 2o5j s VAL 719 CO 0.38 -0.83 1.24 0.18 0.00 0.00 0.00 175.10 176.07 2o5j n LEU 720 N 3.54 0.98 -4.19 3.92 4.32 -1.25 -3.06 117.00 121.25 2o5j n LEU 720 Ca 0.06 1.14 -0.12 0.00 -0.02 0.00 0.00 56.01 57.07 2o5j n LEU 720 Cb 0.37 -1.08 -0.10 0.00 -1.62 0.00 0.00 43.42 40.99 2o5j n LEU 720 CO 0.33 -1.39 -0.34 0.68 -1.22 0.00 0.00 177.39 175.45 2o5j s VAL 721 N 0.35 0.56 0.40 4.08 -7.23 -0.48 -4.87 120.40 113.20 2o5j s VAL 721 Ca 0.87 -1.94 -0.21 0.00 -1.81 0.00 0.00 61.98 58.89 2o5j s VAL 721 Cb -1.09 -1.93 -0.11 0.00 0.56 0.00 0.00 36.38 33.81 2o5j s VAL 721 CO 0.51 -0.63 0.92 -1.61 -0.31 0.00 0.00 175.10 173.98 2o5j s GLU 722 N -3.91 4.25 0.00 4.82 0.41 -1.26 -0.78 118.70 122.23 2o5j s GLU 722 Ca 0.19 1.09 0.00 0.00 -0.41 0.00 0.00 54.97 55.84 2o5j s GLU 722 Cb 0.06 -2.31 0.00 0.00 -1.78 0.00 0.00 34.13 30.10 2o5j s GLU 722 CO -0.00 0.05 0.00 0.41 -0.49 0.00 0.00 175.26 175.23 2o5j n GLY 723 N -0.41 -2.08 0.13 -1.39 0.00 -1.26 -4.81 105.19 95.38 2o5j n GLY 723 Ca 0.06 -2.13 -0.22 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.07 0.67 -1.36 1.61 10.64 -1.26 -4.72 117.38 122.90 2o5j n GLN 724 Ca 0.00 0.34 -0.31 0.00 -1.83 0.00 0.00 57.00 55.20 2o5j n GLN 724 Cb 0.00 -1.67 0.08 0.00 -0.86 0.00 0.00 30.24 27.79 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 -6.97 4.63 -0.21 2.61 1.04 -1.26 -4.59 113.70 108.95 2o5j s SER 725 Ca -0.28 1.85 -0.04 0.00 0.48 0.00 0.00 55.95 57.96 2o5j s SER 725 Cb 0.08 -2.53 -0.01 0.00 0.10 0.00 0.00 66.02 63.66 2o5j s SER 725 CO 0.66 -1.95 -0.03 -0.63 0.98 0.00 0.00 173.24 172.27 2o5j s ILE 726 N -2.81 3.55 -0.31 -1.02 1.01 0.05 -4.31 121.20 117.36 2o5j s ILE 726 Ca 0.62 -0.44 -0.29 0.00 0.00 0.00 0.00 60.65 60.54 2o5j s ILE 726 Cb -0.18 -2.61 0.02 0.00 0.01 0.00 0.00 42.46 39.70 2o5j s ILE 726 CO 0.53 0.43 1.06 -1.10 0.00 0.00 0.00 174.94 175.86 2o5j s GLN 727 N 1.29 4.08 0.18 2.79 -0.21 0.15 -1.09 119.66 126.84 2o5j s GLN 727 Ca 0.04 1.07 0.05 0.00 0.02 0.00 0.00 55.36 56.54 2o5j s GLN 727 Cb -0.14 -3.73 -0.04 0.00 1.00 0.00 0.00 33.01 30.10 2o5j s GLN 727 CO -0.01 -0.87 0.16 -1.17 -2.12 0.00 0.00 175.29 171.28 2o5j s LEU 728 N 3.59 3.86 0.37 2.90 2.96 -0.81 0.18 118.68 131.72 2o5j s LEU 728 Ca 0.45 -0.13 -0.21 0.00 -0.22 0.00 0.00 54.13 54.02 2o5j s LEU 728 Cb -0.12 -2.45 -0.10 0.00 0.50 0.00 0.00 46.19 44.02 2o5j s LEU 728 CO 0.14 0.05 0.90 -2.28 -1.32 0.00 0.00 176.35 173.83 2o5j s HIS 729 N -1.82 3.45 0.17 5.38 5.65 -1.26 -1.29 115.29 125.57 2o5j s HIS 729 Ca 0.32 1.58 -0.06 0.00 0.25 0.00 0.00 55.06 57.15 2o5j s HIS 729 Cb -0.10 -2.80 0.06 0.00 -1.18 0.00 0.00 32.58 28.56 2o5j s HIS 729 CO 0.24 0.05 1.48 -1.00 -0.65 0.00 0.00 174.74 174.86 2o5j h PRO 730 N 2.44 0.66 0.00 2.88 0.13 -1.91 -3.22 132.00 132.98 2o5j h PRO 730 Ca -0.48 -0.41 -0.04 0.00 -0.87 0.00 0.00 66.00 64.20 2o5j h PRO 730 Cb 1.18 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 2o5j h PRO 730 CO 0.63 1.03 -0.17 -0.07 -0.23 0.00 0.00 178.00 179.19 2o5j h LEU 731 N 0.51 0.00 -0.15 1.56 3.38 -1.96 -1.36 115.31 117.29 2o5j h LEU 731 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2o5j h LEU 731 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2o5j h LEU 731 CO 0.11 0.17 -0.15 0.52 0.09 0.00 0.00 178.44 179.17 2o5j n VAL 732 N -4.30 0.00 0.69 1.22 0.31 -1.22 -3.47 118.33 111.56 2o5j n VAL 732 Ca -0.02 -0.04 0.06 0.00 -0.01 0.00 0.00 64.34 64.33 2o5j n VAL 732 Cb 0.23 -0.12 0.34 0.00 -0.91 0.00 0.00 33.84 33.39 2o5j n VAL 732 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2o5j h GLU 734 N 0.00 0.00 0.00 0.00 5.08 -1.73 -3.27 114.58 114.66 2o5j h GLU 734 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2o5j h GLU 734 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2o5j h GLU 734 CO 0.00 0.91 0.00 0.00 -1.00 0.00 0.00 179.01 178.92 2o5j n ALA 735 N -3.23 -0.06 -2.08 3.43 0.00 -0.72 -3.83 120.51 114.02 2o5j n ALA 735 Ca -0.25 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.77 2o5j n ALA 735 Cb 0.59 0.23 -0.03 0.00 0.00 0.00 0.00 19.45 20.25 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 -1.79 2.76 -0.97 0.00 0.40 -1.06 -4.85 117.98 112.47 2o5j s PHE 736 Ca 0.00 0.63 -0.22 0.00 -0.60 0.00 0.00 56.93 56.74 2o5j s PHE 736 Cb 0.00 -3.80 -0.12 0.00 0.51 0.00 0.00 43.02 39.61 2o5j s PHE 736 CO 0.00 -3.06 1.93 -1.71 0.70 0.00 0.00 175.22 173.07 2o5j n ASN 737 N 5.14 2.88 -4.23 1.36 5.15 -1.25 -4.59 115.26 119.72 2o5j n ASN 737 Ca 0.14 -2.70 -0.22 0.00 -0.60 0.00 0.00 54.58 51.20 2o5j n ASN 737 Cb 0.42 -1.39 -0.12 0.00 -0.53 0.00 0.00 39.78 38.15 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 7.20 1.52 -0.24 5.20 0.00 -1.23 -4.96 121.76 129.25 2o5j s ALA 738 Ca 0.61 -1.11 -0.10 0.00 0.00 0.00 0.00 51.96 51.36 2o5j s ALA 738 Cb 0.08 -0.19 0.09 0.00 0.00 0.00 0.00 23.12 23.10 2o5j s ALA 738 CO 0.12 0.28 0.55 0.16 0.00 0.00 0.00 175.76 176.87 2o5j s ASP 739 N -1.74 -0.73 -1.03 0.00 1.47 -1.26 -4.78 116.67 108.60 2o5j s ASP 739 Ca 0.03 1.26 -0.27 0.00 1.18 0.00 0.00 52.55 54.76 2o5j s ASP 739 Cb -0.10 1.51 -0.21 0.00 -0.34 0.00 0.00 42.92 43.78 2o5j s ASP 739 CO 0.03 -0.22 2.18 -0.36 0.68 0.00 0.00 175.17 177.48 2o5j s PHE 740 N 2.22 1.18 -0.16 2.11 0.40 -1.26 -4.50 117.98 117.95 2o5j s PHE 740 Ca -0.06 2.32 -0.07 0.00 -0.60 0.00 0.00 56.93 58.52 2o5j s PHE 740 Cb -0.10 -3.32 0.07 0.00 0.51 0.00 0.00 43.02 40.18 2o5j s PHE 740 CO -0.16 -0.81 0.37 0.16 0.70 0.00 0.00 175.22 175.47 2o5j s ASP 741 N 9.05 -0.24 0.00 1.36 -4.77 -1.26 -5.00 116.67 115.81 2o5j s ASP 741 Ca 0.84 0.83 0.00 0.00 -3.30 0.00 0.00 52.55 50.92 2o5j s ASP 741 Cb -0.07 0.91 0.00 0.00 -1.09 0.00 0.00 42.92 42.68 2o5j s ASP 741 CO 0.16 -0.21 0.00 0.61 0.70 0.00 0.00 175.17 176.43 2o5j n GLY 742 N 4.84 0.00 3.85 2.12 0.00 -1.26 -4.85 105.19 109.89 2o5j n GLY 742 Ca -0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 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 6.57 0.01 1.61 -4.77 -1.26 -5.04 116.67 113.80 2o5j s ASP 743 Ca 0.00 1.44 0.03 0.00 -3.30 0.00 0.00 52.55 50.72 2o5j s ASP 743 Cb 0.00 -2.46 -0.01 0.00 -1.09 0.00 0.00 42.92 39.36 2o5j s ASP 743 CO 0.00 -0.55 -0.09 -1.10 0.70 0.00 0.00 175.17 174.13 2o5j s GLN 744 N -4.07 0.63 -0.03 2.11 -0.21 -1.26 -3.91 119.66 112.92 2o5j s GLN 744 Ca 0.57 -0.47 0.02 0.00 0.02 0.00 0.00 55.36 55.50 2o5j s GLN 744 Cb -0.10 -0.56 -0.03 0.00 1.00 0.00 0.00 33.01 33.32 2o5j s GLN 744 CO 0.32 0.14 -0.07 -1.64 -2.12 0.00 0.00 175.29 171.93 2o5j s MET 745 N -0.69 2.63 0.78 2.91 -1.94 -1.17 -4.38 119.30 117.43 2o5j s MET 745 Ca -0.01 -0.65 -0.07 0.00 -1.71 0.00 0.00 55.69 53.26 2o5j s MET 745 Cb -0.05 -2.54 0.13 0.00 2.01 0.00 0.00 34.83 34.38 2o5j s MET 745 CO 0.00 0.63 1.09 0.00 -0.01 0.00 0.00 175.02 176.73 2o5j s ALA 746 N -0.92 3.15 -0.14 3.03 0.00 -0.31 -3.13 121.76 123.44 2o5j s ALA 746 Ca 0.15 -1.37 -0.13 0.00 0.00 0.00 0.00 51.96 50.62 2o5j s ALA 746 Cb -0.11 -2.38 0.04 0.00 0.00 0.00 0.00 23.12 20.67 2o5j s ALA 746 CO 0.05 -1.68 0.38 0.54 0.00 0.00 0.00 175.76 175.05 2o5j s VAL 747 N -3.37 -0.00 0.29 0.00 0.11 0.26 -1.91 120.40 115.78 2o5j s VAL 747 Ca 0.67 0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.75 2o5j s VAL 747 Cb -0.06 -0.53 -0.06 0.00 -1.53 0.00 0.00 36.38 34.20 2o5j s VAL 747 CO 0.47 0.00 0.06 -1.00 -3.33 0.00 0.00 175.10 171.30 2o5j s HIS 748 N 0.29 1.79 -0.03 1.54 3.76 0.13 -0.67 115.29 122.10 2o5j s HIS 748 Ca -0.01 -1.02 0.01 0.00 -0.15 0.00 0.00 55.06 53.89 2o5j s HIS 748 Cb -0.03 -1.12 0.02 0.00 1.11 0.00 0.00 32.58 32.55 2o5j s HIS 748 CO -0.00 -0.11 -0.04 0.14 -0.85 0.00 0.00 174.74 173.88 2o5j s VAL 749 N -3.45 0.42 -0.14 -0.90 -7.23 -1.16 -1.61 120.40 106.33 2o5j s VAL 749 Ca 0.36 -0.11 -0.29 0.00 -1.81 0.00 0.00 61.98 60.13 2o5j s VAL 749 Cb 0.08 -0.43 -0.02 0.00 0.56 0.00 0.00 36.38 36.57 2o5j s VAL 749 CO 0.14 0.17 1.28 -2.84 -0.31 0.00 0.00 175.10 173.55 2o5j s PRO 750 N 0.62 4.25 -0.15 4.82 0.02 -1.26 -4.95 135.00 138.36 2o5j s PRO 750 Ca -0.07 1.70 -0.20 0.00 0.02 0.00 0.00 61.00 62.45 2o5j s PRO 750 Cb -0.11 -3.74 -0.24 0.00 0.02 0.00 0.00 34.50 30.43 2o5j s PRO 750 CO -0.00 -0.67 0.48 -0.07 -0.33 0.00 0.00 177.00 176.40 2o5j h LEU 751 N 9.46 0.19-10.22 -5.54 3.38 -1.97 -3.42 115.31 107.18 2o5j h LEU 751 Ca -0.29 -0.77 -0.50 0.00 0.09 0.00 0.00 57.88 56.42 2o5j h LEU 751 Cb 1.12 -0.06 0.07 0.00 0.09 0.00 0.00 40.66 41.88 2o5j h LEU 751 CO 0.95 1.47 0.37 -0.55 0.09 0.00 0.00 178.44 180.78 2o5j s SER 752 N -6.83 5.66 0.52 -0.43 0.15 -1.26 -4.91 113.70 106.60 2o5j s SER 752 Ca -0.23 1.79 0.23 0.00 0.70 0.00 0.00 55.95 58.44 2o5j s SER 752 Cb 0.04 -2.53 1.41 0.00 -1.71 0.00 0.00 66.02 63.23 2o5j s SER 752 CO 0.69 -1.25 2.12 0.77 1.20 0.00 0.00 173.24 176.78 2o5j h SER 753 N 0.19 0.00 0.25 5.45 4.64 -1.99 -1.69 113.55 120.39 2o5j h SER 753 Ca -0.46 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.85 2o5j h SER 753 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2o5j h SER 753 CO 0.57 0.08 -0.12 0.15 -0.87 0.00 0.00 176.83 176.64 2o5j h PHE 754 N 0.00 -0.31 -0.92 4.77 3.57 -1.98 -1.84 116.94 120.23 2o5j h PHE 754 Ca -0.00 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.63 2o5j h PHE 754 Cb 0.17 0.10 -0.09 0.00 2.79 0.00 0.00 35.95 38.93 2o5j h PHE 754 CO 0.00 0.04 0.53 0.00 -2.23 0.00 0.00 178.31 176.66 2o5j h ALA 755 N -0.52 1.39 -0.07 2.41 0.00 -1.89 -0.52 119.26 120.07 2o5j h ALA 755 Ca -0.03 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2o5j h ALA 755 Cb 0.49 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2o5j h ALA 755 CO 0.06 0.06 0.00 0.37 0.00 0.00 0.00 179.25 179.74 2o5j h GLN 756 N 0.80 0.03 0.16 0.00 5.75 -1.37 0.12 115.11 120.60 2o5j h GLN 756 Ca 0.48 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.98 2o5j h GLN 756 Cb 0.58 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.09 2o5j h GLN 756 CO -0.31 0.02 -0.42 0.00 -2.65 0.00 0.00 178.83 175.47 2o5j h ALA 757 N 1.06 -0.95 -0.35 3.38 0.00 -0.26 -1.38 119.26 120.76 2o5j h ALA 757 Ca 0.03 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.89 2o5j h ALA 757 Cb 0.03 0.77 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 2o5j h ALA 757 CO -0.05 -1.03 0.08 1.05 0.00 0.00 0.00 179.25 179.30 2o5j h GLU 758 N -0.64 0.20 -0.93 0.00 4.11 -1.09 -0.56 114.58 115.66 2o5j h GLU 758 Ca -0.02 -0.01 0.11 0.00 0.07 0.00 0.00 59.36 59.51 2o5j h GLU 758 Cb 0.62 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.75 2o5j h GLU 758 CO -0.19 0.13 0.60 0.00 0.07 0.00 0.00 179.01 179.62 2o5j h ALA 759 N 1.26 1.62 0.00 1.06 0.00 -0.57 0.15 119.26 122.77 2o5j h ALA 759 Ca 0.17 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2o5j h ALA 759 Cb 0.18 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2o5j h ALA 759 CO -0.21 0.17 -1.13 2.89 0.00 0.00 0.00 179.25 180.98 2o5j n ARG 760 N -4.56 0.34 -0.08 0.00 1.85 -0.54 -2.42 116.66 111.26 2o5j n ARG 760 Ca 0.17 -0.01 -0.22 0.00 -1.00 0.00 0.00 57.85 56.78 2o5j n ARG 760 Cb 0.34 -1.60 -0.12 0.00 -1.05 0.00 0.00 32.46 30.03 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 -2.03 1.61 0.07 8.89 5.41 -0.26 -4.51 119.36 128.55 2o5j n ILE 761 Ca 0.01 -0.44 0.01 0.00 1.00 0.00 0.00 62.75 63.33 2o5j n ILE 761 Cb 0.45 -1.76 0.01 0.00 -0.71 0.00 0.00 39.64 37.63 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 -3.79 -0.23 0.00 0.38 10.64 0.47 -4.72 117.38 120.14 2o5j n GLN 762 Ca -0.39 -0.56 0.02 0.00 -1.83 0.00 0.00 57.00 54.24 2o5j n GLN 762 Cb 0.92 -1.00 0.01 0.00 -0.86 0.00 0.00 30.24 29.31 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 0.01 1.36 -1.27 2.61 1.56 -1.01 -5.00 117.12 115.38 2o5j n MET 763 Ca 0.01 -0.50 -0.31 0.00 -0.27 0.00 0.00 57.70 56.63 2o5j n MET 763 Cb 0.04 -0.95 0.09 0.00 2.15 0.00 0.00 33.22 34.56 2o5j n MET 763 CO 0.00 0.00 0.00 -1.17 -0.73 0.00 0.00 175.97 174.07 2o5j s LEU 764 N -0.83 2.98 0.03 -0.89 2.96 -1.06 -0.93 118.68 120.94 2o5j s LEU 764 Ca 0.03 1.79 -0.29 0.00 -0.22 0.00 0.00 54.13 55.44 2o5j s LEU 764 Cb 0.03 -4.48 -0.17 0.00 0.50 0.00 0.00 46.19 42.08 2o5j s LEU 764 CO 0.07 -2.06 1.26 0.77 -1.32 0.00 0.00 176.35 175.08 2o5j h SER 765 N -1.14 -0.79 0.01 3.68 4.64 -1.80 -3.28 113.55 114.86 2o5j h SER 765 Ca -0.44 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2o5j h SER 765 Cb 1.23 0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 2o5j h SER 765 CO 0.52 -0.44 0.00 0.00 -0.87 0.00 0.00 176.83 176.04 2o5j n ALA 766 N -2.64 1.32 -0.03 5.18 0.00 -1.26 -2.04 120.51 121.04 2o5j n ALA 766 Ca -0.13 -0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.23 2o5j n ALA 766 Cb 0.38 -1.01 -0.14 0.00 0.00 0.00 0.00 19.45 18.68 2o5j n ALA 766 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2o5j n HIS 767 N -1.21 0.88 -3.16 0.00 8.25 -1.24 -4.53 115.22 114.21 2o5j n HIS 767 Ca 0.00 0.32 -0.43 0.00 -0.26 0.00 0.00 57.72 57.36 2o5j n HIS 767 Cb 0.00 -1.16 -0.00 0.00 1.12 0.00 0.00 29.99 29.95 2o5j n HIS 767 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2o5j n ASN 768 N -3.00 5.92 0.03 0.41 3.02 -0.86 -4.76 115.26 116.02 2o5j n ASN 768 Ca -0.18 -3.28 -0.21 0.00 -0.03 0.00 0.00 54.58 50.88 2o5j n ASN 768 Cb 1.06 -1.27 -0.14 0.00 -0.61 0.00 0.00 39.78 38.82 2o5j n ASN 768 CO 0.00 0.00 0.00 0.17 -2.62 0.00 0.00 177.26 174.81 2o5j h LEU 769 N 5.79 0.44 -9.99 3.41 8.10 -1.80 -3.47 115.31 117.79 2o5j h LEU 769 Ca 0.19 -0.91 -0.50 0.00 0.11 0.00 0.00 57.88 56.77 2o5j h LEU 769 Cb 0.71 -0.14 -0.03 0.00 -0.44 0.00 0.00 40.66 40.76 2o5j h LEU 769 CO 1.19 1.48 0.05 -0.76 -4.11 0.00 0.00 178.44 176.29 2o5j s LEU 770 N -7.76 4.11 0.39 0.17 1.43 -1.26 -1.84 118.68 113.92 2o5j s LEU 770 Ca -0.16 1.22 -0.13 0.00 -1.03 0.00 0.00 54.13 54.03 2o5j s LEU 770 Cb 0.02 -3.95 -0.08 0.00 0.03 0.00 0.00 46.19 42.22 2o5j s LEU 770 CO 0.81 -0.16 0.78 -0.94 0.23 0.00 0.00 176.35 177.07 2o5j s SER 771 N -2.23 6.63 0.39 2.29 1.04 -1.18 -4.88 113.70 115.76 2o5j s SER 771 Ca 0.52 1.24 0.21 0.00 0.48 0.00 0.00 55.95 58.40 2o5j s SER 771 Cb -0.11 -2.36 0.64 0.00 0.10 0.00 0.00 66.02 64.28 2o5j s SER 771 CO 0.18 -0.35 1.70 -0.65 0.98 0.00 0.00 173.24 175.10 2o5j h PRO 772 N 1.57 0.00 0.42 4.02 0.11 -1.94 -3.32 132.00 132.86 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 0.64 0.29 -0.20 0.00 -0.21 0.00 0.00 178.00 178.52 2o5j h ALA 773 N 1.71 -0.56 -3.02 -0.75 0.00 -1.91 -3.44 119.26 111.28 2o5j h ALA 773 Ca -0.00 -0.13 -0.64 0.00 0.00 0.00 0.00 54.91 54.14 2o5j h ALA 773 Cb 0.95 0.22 -0.18 0.00 0.00 0.00 0.00 17.79 18.77 2o5j h ALA 773 CO 0.04 -0.53 -0.81 -1.54 0.00 0.00 0.00 179.25 176.41 2o5j s SER 774 N -4.91 3.43 0.00 0.00 1.04 -0.85 0.18 113.70 112.58 2o5j s SER 774 Ca -0.09 -0.89 0.05 0.00 0.48 0.00 0.00 55.95 55.50 2o5j s SER 774 Cb 0.01 -0.26 0.30 0.00 0.10 0.00 0.00 66.02 66.17 2o5j s SER 774 CO 0.26 0.10 0.84 0.61 0.98 0.00 0.00 173.24 176.03 2o5j n GLY 775 N 0.12 -0.59 3.79 7.32 0.00 -1.26 -3.57 105.19 111.00 2o5j n GLY 775 Ca -0.11 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 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 4.53 0.93 1.61 0.41 -1.26 -4.84 118.70 118.08 2o5j s GLU 776 Ca 0.08 1.22 -0.10 0.00 -0.41 0.00 0.00 54.97 55.76 2o5j s GLU 776 Cb 0.03 -2.90 0.15 0.00 -1.78 0.00 0.00 34.13 29.64 2o5j s GLU 776 CO 0.06 0.35 1.13 -2.14 -0.49 0.00 0.00 175.26 174.17 2o5j s PRO 777 N -1.88 0.91 0.00 0.39 0.02 -1.26 -3.12 135.00 130.05 2o5j s PRO 777 Ca 0.47 1.47 0.00 0.00 0.02 0.00 0.00 61.00 62.96 2o5j s PRO 777 Cb -0.19 -1.72 0.00 0.00 0.02 0.00 0.00 34.50 32.61 2o5j s PRO 777 CO 0.24 -2.68 0.00 -0.11 -0.33 0.00 0.00 177.00 174.12 2o5j n LEU 778 N -4.26 0.00 -2.63 -5.54 7.94 -0.77 -4.76 117.00 106.98 2o5j n LEU 778 Ca 0.11 -0.32 -0.27 0.00 -1.11 0.00 0.00 56.01 54.41 2o5j n LEU 778 Cb 0.52 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.41 2o5j n LEU 778 CO 0.50 0.00 1.82 0.00 -1.11 0.00 0.00 177.39 178.60 2o5j n ALA 779 N -0.90 6.56 -2.48 1.96 0.00 -1.22 -4.78 120.51 119.65 2o5j n ALA 779 Ca 0.00 -3.06 -0.38 0.00 0.00 0.00 0.00 53.44 50.00 2o5j n ALA 779 Cb 0.00 -2.35 -0.06 0.00 0.00 0.00 0.00 19.45 17.04 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 -0.99 4.11 0.26 0.00 1.02 -1.26 -5.00 119.74 117.88 2o5j s LYS 780 Ca 0.60 0.53 -0.31 0.00 0.02 0.00 0.00 55.97 56.81 2o5j s LYS 780 Cb 0.33 -3.28 -0.13 0.00 -0.52 0.00 0.00 37.83 34.23 2o5j s LYS 780 CO -0.16 0.55 1.40 -2.30 -0.92 0.00 0.00 175.35 173.92 2o5j n PRO 781 N 2.23 2.09 -0.25 -1.68 -0.02 -1.26 -4.95 135.00 131.17 2o5j n PRO 781 Ca -0.11 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2o5j n PRO 781 Cb 0.52 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 2o5j n PRO 781 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2o5j n SER 782 N 1.90 0.00 -0.26 2.55 7.64 -1.26 -4.62 113.62 119.57 2o5j n SER 782 Ca 0.10 -0.88 0.03 0.00 1.01 0.00 0.00 58.87 59.13 2o5j n SER 782 Cb 0.33 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.64 2o5j n SER 782 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2o5j h ARG 783 N 0.00 0.03 0.31 1.43 3.08 -1.75 -1.36 114.38 116.12 2o5j h ARG 783 Ca 0.00 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2o5j h ARG 783 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2o5j h ARG 783 CO 0.00 0.02 -0.15 -0.44 -1.07 0.00 0.00 179.97 178.33 2o5j h ASP 784 N 0.03 -0.35 -0.67 7.04 3.45 -1.93 -3.05 116.42 120.94 2o5j h ASP 784 Ca 0.38 -0.18 -0.03 0.00 0.43 0.00 0.00 57.03 57.62 2o5j h ASP 784 Cb 0.62 0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 39.45 2o5j h ASP 784 CO -0.74 0.05 0.29 0.40 -1.57 0.00 0.00 179.24 177.67 2o5j h ILE 785 N -0.82 1.23 -0.27 0.35 5.03 -1.77 -3.00 117.51 118.27 2o5j h ILE 785 Ca -0.04 -0.70 0.04 0.00 -0.12 0.00 0.00 64.86 64.04 2o5j h ILE 785 Cb 0.52 0.45 -0.04 0.00 -3.03 0.00 0.00 36.82 34.72 2o5j h ILE 785 CO 0.07 0.28 0.01 0.40 -0.68 0.00 0.00 178.15 178.23 2o5j h ILE 786 N 0.94 0.82 -0.96 -0.67 2.04 -1.34 -0.26 117.51 118.07 2o5j h ILE 786 Ca 0.23 -0.03 0.15 0.00 1.00 0.00 0.00 64.86 66.20 2o5j h ILE 786 Cb 0.17 0.71 -0.08 0.00 -0.74 0.00 0.00 36.82 36.88 2o5j h ILE 786 CO -0.02 0.02 0.61 0.25 0.00 0.00 0.00 178.15 179.00 2o5j h LEU 787 N 0.09 0.77 0.00 1.44 5.85 -1.44 0.19 115.31 122.21 2o5j h LEU 787 Ca 0.13 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 2o5j h LEU 787 Cb 0.16 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.10 2o5j h LEU 787 CO -0.21 0.37 -0.23 1.23 -0.34 0.00 0.00 178.44 179.25 2o5j h GLY 788 N 0.80 0.17 2.00 3.75 0.00 -1.18 -3.04 103.07 105.57 2o5j h GLY 788 Ca 0.50 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.52 2o5j h GLY 788 CO -0.26 0.27 0.00 1.41 0.00 0.00 0.00 176.54 177.95 2o5j h LEU 789 N -0.55 0.00 0.13 3.11 3.38 -0.76 -3.15 115.31 117.47 2o5j h LEU 789 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2o5j h LEU 789 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2o5j h LEU 789 CO 0.05 0.00 -0.06 0.22 0.09 0.00 0.00 178.44 178.73 2o5j h TYR 790 N 0.00 -0.16 -0.99 1.13 5.03 -0.69 -3.30 116.97 117.99 2o5j h TYR 790 Ca 0.00 -0.00 0.25 0.00 2.58 0.00 0.00 58.73 61.55 2o5j h TYR 790 Cb 0.47 0.05 -0.18 0.00 1.55 0.00 0.00 36.73 38.62 2o5j h TYR 790 CO 0.00 -0.10 -0.06 -0.92 -1.32 0.00 0.00 178.16 175.76 2o5j h TYR 791 N -0.84 -0.21 0.00 -3.82 3.20 -1.56 0.25 116.97 114.00 2o5j h TYR 791 Ca -0.02 0.08 -0.05 0.00 3.14 0.00 0.00 58.73 61.88 2o5j h TYR 791 Cb 0.13 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 2o5j h TYR 791 CO 0.01 -0.43 -0.23 0.97 -1.64 0.00 0.00 178.16 176.83 2o5j h ILE 792 N 0.01 1.07 0.00 1.81 -0.00 -1.70 -3.18 117.51 115.52 2o5j h ILE 792 Ca 0.56 -0.83 0.00 0.00 -0.00 0.00 0.00 64.86 64.59 2o5j h ILE 792 Cb 1.06 1.46 0.00 0.00 -0.00 0.00 0.00 36.82 39.34 2o5j h ILE 792 CO -0.95 0.23 -0.96 0.35 -0.00 0.00 0.00 178.15 176.82 2o5j n THR 793 N -4.12 0.01 -2.58 2.19 -2.24 0.84 -3.86 114.28 104.51 2o5j n THR 793 Ca -0.02 -0.04 -0.36 0.00 -2.27 0.00 0.00 64.05 61.36 2o5j n THR 793 Cb 0.30 0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 69.25 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 -3.04 4.22 -0.09 -0.78 0.74 -0.93 -4.58 119.66 115.20 2o5j s GLN 794 Ca 0.08 1.48 -0.05 0.00 0.05 0.00 0.00 55.36 56.91 2o5j s GLN 794 Cb 0.16 -2.56 -0.04 0.00 1.10 0.00 0.00 33.01 31.67 2o5j s GLN 794 CO 0.84 -0.09 0.13 0.08 -0.55 0.00 0.00 175.29 175.70 2o5j s VAL 795 N -1.67 5.35 0.19 1.34 1.01 -1.25 -4.32 120.40 121.04 2o5j s VAL 795 Ca 0.57 0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.67 2o5j s VAL 795 Cb -0.21 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2o5j s VAL 795 CO 0.27 0.54 0.13 -0.13 0.00 0.00 0.00 175.10 175.91 2o5j s ARG 796 N -1.25 2.85 0.00 2.72 0.52 -0.89 -5.04 118.95 117.86 2o5j s ARG 796 Ca 0.18 -0.94 0.04 0.00 -0.52 0.00 0.00 55.73 54.48 2o5j s ARG 796 Cb -0.12 -2.59 -0.01 0.00 0.52 0.00 0.00 34.95 32.75 2o5j s ARG 796 CO 0.08 0.46 -0.11 0.15 0.02 0.00 0.00 175.30 175.89 2o5j s LYS 797 N -3.27 0.89 0.16 3.54 3.01 -1.26 -4.79 119.74 118.03 2o5j s LYS 797 Ca 0.31 -0.46 0.00 0.00 -1.01 0.00 0.00 55.97 54.81 2o5j s LYS 797 Cb -0.09 -0.86 0.00 0.00 -1.01 0.00 0.00 37.83 35.86 2o5j s LYS 797 CO 0.23 0.23 0.00 -1.91 0.51 0.00 0.00 175.35 174.41 2o5j n GLU 798 N 2.63 0.00 -3.70 1.68 4.07 -0.70 -4.96 120.64 119.66 2o5j n GLU 798 Ca -0.15 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 56.85 2o5j n GLU 798 Cb 0.56 -0.08 -0.11 0.00 -0.06 0.00 0.00 31.44 31.75 2o5j n GLU 798 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2o5j s LYS 799 N -1.65 0.42 -0.33 5.31 2.20 -1.26 -5.07 119.74 119.36 2o5j s LYS 799 Ca 0.00 0.76 -0.00 0.00 -0.36 0.00 0.00 55.97 56.37 2o5j s LYS 799 Cb 0.00 0.03 0.10 0.00 -1.51 0.00 0.00 37.83 36.46 2o5j s LYS 799 CO 0.00 -0.14 0.11 0.21 -0.36 0.00 0.00 175.35 175.17 2o5j s LYS 800 N 1.18 0.82 -0.14 4.03 2.20 -1.26 -3.94 119.74 122.64 2o5j s LYS 800 Ca -0.08 -1.23 -0.03 0.00 -0.36 0.00 0.00 55.97 54.28 2o5j s LYS 800 Cb -0.07 -2.10 -0.08 0.00 -1.51 0.00 0.00 37.83 34.07 2o5j s LYS 800 CO -0.10 -1.01 -0.15 0.41 -0.36 0.00 0.00 175.35 174.14 2o5j n GLY 801 N 4.66 -0.20 3.84 5.54 0.00 -1.26 -5.02 105.19 112.75 2o5j n GLY 801 Ca -0.00 -0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.26 3.77 0.00 4.61 0.00 -1.26 -5.03 121.76 121.59 2o5j s ALA 802 Ca -0.19 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 50.84 2o5j s ALA 802 Cb 0.06 -1.62 0.00 0.00 0.00 0.00 0.00 23.12 21.56 2o5j s ALA 802 CO 0.28 0.78 0.00 0.41 0.00 0.00 0.00 175.76 177.24 2o5j n GLY 803 N 0.42 0.00 0.12 0.00 0.00 -1.26 -4.94 105.19 99.54 2o5j n GLY 803 Ca -0.07 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.00 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 2.33 -3.39 0.99 -0.00 -1.26 -4.91 117.00 110.77 2o5j n LEU 804 Ca 0.00 -2.57 -0.40 0.00 -0.00 0.00 0.00 56.01 53.04 2o5j n LEU 804 Cb 0.00 -0.25 0.03 0.00 -0.00 0.00 0.00 43.42 43.20 2o5j n LEU 804 CO 0.00 0.62 1.45 -0.62 -0.00 0.00 0.00 177.39 178.84 2o5j n GLU 805 N -0.88 4.52 0.25 1.47 1.02 -1.26 -4.00 120.64 121.76 2o5j n GLU 805 Ca 0.09 -4.29 0.11 0.00 -0.02 0.00 0.00 57.16 53.05 2o5j n GLU 805 Cb 0.48 -2.40 0.66 0.00 -0.02 0.00 0.00 31.44 30.16 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 3.78 0.00 -0.76 -0.32 3.57 -1.88 -3.26 116.94 118.08 2o5j h PHE 806 Ca 0.54 0.00 0.28 0.00 3.53 0.00 0.00 57.97 62.32 2o5j h PHE 806 Cb 0.23 0.00 -0.09 0.00 2.79 0.00 0.00 35.95 38.87 2o5j h PHE 806 CO 1.28 0.15 0.47 0.00 -2.23 0.00 0.00 178.31 177.97 2o5j n ALA 807 N -2.31 0.76 0.02 2.41 0.00 -1.26 -3.59 120.51 116.55 2o5j n ALA 807 Ca -0.02 0.55 -0.01 0.00 0.00 0.00 0.00 53.44 53.96 2o5j n ALA 807 Cb 0.26 -0.63 -0.00 0.00 0.00 0.00 0.00 19.45 19.08 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 -4.04 1.24 -2.20 0.00 -2.24 -1.23 -5.06 114.28 100.76 2o5j n THR 808 Ca 0.24 0.35 -0.35 0.00 -2.27 0.00 0.00 64.05 62.02 2o5j n THR 808 Cb 0.89 -1.70 0.01 0.00 -2.10 0.00 0.00 70.33 67.43 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 -2.11 3.28 0.09 -0.78 0.02 -1.24 -4.92 135.00 129.35 2o5j s PRO 809 Ca -0.05 1.68 0.24 0.00 0.02 0.00 0.00 61.00 62.89 2o5j s PRO 809 Cb 0.01 -2.01 0.32 0.00 0.02 0.00 0.00 34.50 32.84 2o5j s PRO 809 CO 0.07 -0.92 1.29 -0.85 -0.33 0.00 0.00 177.00 176.26 2o5j n GLU 810 N -1.33 0.26 0.09 5.54 0.28 -1.26 -3.20 120.64 121.02 2o5j n GLU 810 Ca 0.12 0.06 0.01 0.00 -0.16 0.00 0.00 57.16 57.20 2o5j n GLU 810 Cb 0.50 -1.65 -0.02 0.00 1.43 0.00 0.00 31.44 31.70 2o5j n GLU 810 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2o5j h GLU 811 N 0.00 0.00 -0.02 3.44 -0.00 -1.97 -3.09 114.58 112.94 2o5j h GLU 811 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 59.36 59.27 2o5j h GLU 811 Cb 0.71 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.45 2o5j h GLU 811 CO 0.00 0.42 -0.39 0.00 -0.00 0.00 0.00 179.01 179.03 2o5j h ALA 812 N 1.47 1.31 0.23 1.06 0.00 -1.90 0.12 119.26 121.56 2o5j h ALA 812 Ca -0.07 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 2o5j h ALA 812 Cb 1.46 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.19 2o5j h ALA 812 CO 0.06 0.51 -0.11 1.37 0.00 0.00 0.00 179.25 181.07 2o5j h LEU 813 N 0.03 -0.27 0.59 0.00 8.10 -1.56 -2.75 115.31 119.45 2o5j h LEU 813 Ca 0.00 -0.26 -0.03 0.00 0.11 0.00 0.00 57.88 57.70 2o5j h LEU 813 Cb 0.71 0.07 0.01 0.00 -0.44 0.00 0.00 40.66 41.01 2o5j h LEU 813 CO 0.05 0.20 -0.28 0.00 -4.11 0.00 0.00 178.44 174.30 2o5j h ALA 814 N -0.30 -1.15 -0.51 0.17 0.00 -1.49 -1.99 119.26 113.99 2o5j h ALA 814 Ca -0.03 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 54.81 2o5j h ALA 814 Cb 0.51 0.31 -0.10 0.00 0.00 0.00 0.00 17.79 18.51 2o5j h ALA 814 CO 0.05 -1.09 -0.19 0.00 0.00 0.00 0.00 179.25 178.02 2o5j h ALA 815 N -1.59 0.21 -0.03 0.00 0.00 -0.91 0.18 119.26 117.12 2o5j h ALA 815 Ca -0.08 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2o5j h ALA 815 Cb 0.61 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2o5j h ALA 815 CO 0.13 -0.52 0.00 0.72 0.00 0.00 0.00 179.25 179.59 2o5j n HIS 816 N -5.40 0.03 -0.03 0.00 8.25 -1.04 -0.29 115.22 116.75 2o5j n HIS 816 Ca 0.04 -0.02 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 2o5j n HIS 816 Cb 0.31 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.27 2o5j n HIS 816 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 2o5j n GLU 817 N -0.47 0.67 0.06 -0.41 2.13 0.47 -3.24 120.64 119.86 2o5j n GLU 817 Ca 0.19 0.25 -0.18 0.00 0.66 0.00 0.00 57.16 58.08 2o5j n GLU 817 Cb 0.19 -1.73 -0.14 0.00 0.27 0.00 0.00 31.44 30.03 2o5j n GLU 817 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2o5j h ARG 818 N 0.02 0.27 -0.31 5.31 3.08 -0.95 -2.76 114.38 119.04 2o5j h ARG 818 Ca -0.36 -0.46 -0.01 0.00 0.07 0.00 0.00 59.98 59.22 2o5j h ARG 818 Cb 2.04 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 32.25 2o5j h ARG 818 CO 0.07 1.13 0.13 0.78 -1.07 0.00 0.00 179.97 181.01 2o5j h GLY 819 N 1.54 0.46 0.84 0.04 0.00 -0.81 0.25 103.07 105.39 2o5j h GLY 819 Ca -0.27 -0.20 -0.13 0.00 0.00 0.00 0.00 47.33 46.73 2o5j h GLY 819 CO 0.16 0.20 -0.42 -2.09 0.00 0.00 0.00 176.54 174.39 2o5j h GLU 820 N 0.44 0.49 -0.63 4.80 4.22 -1.61 -2.54 114.58 119.74 2o5j h GLU 820 Ca 0.11 -0.37 0.12 0.00 0.08 0.00 0.00 59.36 59.30 2o5j h GLU 820 Cb 0.08 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 2o5j h GLU 820 CO -0.01 1.00 0.43 0.28 -2.18 0.00 0.00 179.01 178.52 2o5j h VAL 821 N 0.08 0.83 0.00 0.32 2.07 -1.05 -3.39 116.25 115.11 2o5j h VAL 821 Ca -0.02 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.39 2o5j h VAL 821 Cb 1.05 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 2o5j h VAL 821 CO 0.09 0.06 0.00 0.00 0.02 0.00 0.00 177.57 177.74 2o5j n ALA 822 N -2.54 0.00 0.39 1.67 0.00 0.80 -5.01 120.51 115.82 2o5j n ALA 822 Ca 0.11 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.59 2o5j n ALA 822 Cb 0.46 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.90 2o5j n ALA 822 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2o5j n LEU 823 N 0.00 0.85 0.05 0.00 4.32 -1.21 -4.75 117.00 116.26 2o5j n LEU 823 Ca 0.00 -0.67 -0.12 0.00 -0.02 0.00 0.00 56.01 55.20 2o5j n LEU 823 Cb 0.00 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 41.71 2o5j n LEU 823 CO 0.00 0.18 0.54 -1.13 -1.22 0.00 0.00 177.39 175.76 2o5j h ASN 824 N 0.61 -0.15 -3.52 -1.43 -0.00 -1.77 -3.44 115.58 105.88 2o5j h ASN 824 Ca 0.00 -0.36 -0.65 0.00 -0.00 0.00 0.00 56.30 55.29 2o5j h ASN 824 Cb 0.26 0.04 -0.23 0.00 -0.00 0.00 0.00 38.32 38.39 2o5j h ASN 824 CO 0.00 0.33 -0.65 0.00 -0.00 0.00 0.00 177.43 177.11 2o5j s ALA 825 N -4.24 3.09 1.16 1.57 0.00 -0.99 -4.64 121.76 117.70 2o5j s ALA 825 Ca -0.14 -1.06 -0.17 0.00 0.00 0.00 0.00 51.96 50.58 2o5j s ALA 825 Cb 0.01 -1.92 0.26 0.00 0.00 0.00 0.00 23.12 21.48 2o5j s ALA 825 CO 0.58 -0.33 1.09 -2.14 0.00 0.00 0.00 175.76 174.96 2o5j s PRO 826 N 1.32 -0.84 0.14 0.00 0.02 -1.25 -3.96 135.00 130.43 2o5j s PRO 826 Ca 0.04 0.16 0.27 0.00 0.02 0.00 0.00 61.00 61.49 2o5j s PRO 826 Cb -0.15 -1.62 0.95 0.00 0.02 0.00 0.00 34.50 33.70 2o5j s PRO 826 CO 0.02 -3.51 1.82 -0.89 -0.33 0.00 0.00 177.00 174.12 2o5j n ILE 827 N -4.66 0.40 -3.36 2.83 -0.00 -1.26 -4.13 119.36 109.18 2o5j n ILE 827 Ca 0.10 -0.19 -0.26 0.00 -0.00 0.00 0.00 62.75 62.40 2o5j n ILE 827 Cb 0.59 -0.55 -0.09 0.00 -0.00 0.00 0.00 39.64 39.59 2o5j n ILE 827 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84 2o5j n LYS 828 N -2.01 0.86 -3.91 0.38 5.02 -1.26 -1.66 118.16 115.58 2o5j n LYS 828 Ca 0.06 -3.52 -0.36 0.00 -2.02 0.00 0.00 58.31 52.47 2o5j n LYS 828 Cb 0.40 -1.62 -0.07 0.00 -0.02 0.00 0.00 35.03 33.72 2o5j n LYS 828 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2o5j s VAL 829 N -0.93 5.31 -0.78 -0.18 1.01 -1.26 -1.72 120.40 121.85 2o5j s VAL 829 Ca 0.34 0.14 -0.26 0.00 0.00 0.00 0.00 61.98 62.20 2o5j s VAL 829 Cb 0.10 -3.33 -0.12 0.00 0.00 0.00 0.00 36.38 33.02 2o5j s VAL 829 CO -0.14 0.57 2.36 0.00 0.00 0.00 0.00 175.10 177.90 2o5j s ALA 830 N -0.63 0.84 -0.36 5.51 0.00 -1.26 -4.37 121.76 121.49 2o5j s ALA 830 Ca 0.13 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 51.28 2o5j s ALA 830 Cb -0.12 -4.56 0.15 0.00 0.00 0.00 0.00 23.12 18.59 2o5j s ALA 830 CO 0.02 -5.72 0.25 0.20 0.00 0.00 0.00 175.76 170.51 2o5j s GLY 831 N 10.68 0.85 0.00 0.00 0.00 -1.26 -4.71 107.32 112.88 2o5j s GLY 831 Ca 0.91 -1.91 0.00 0.00 0.00 0.00 0.00 44.72 43.71 2o5j s GLY 831 CO 0.08 2.16 0.00 -2.13 0.00 0.00 0.00 173.10 173.21 2o5j n ARG 832 N 3.80 0.00 0.00 2.90 3.00 -1.26 -1.96 116.66 123.15 2o5j n ARG 832 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.01 2o5j n ARG 832 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.86 2o5j n ARG 832 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2o5j n GLU 833 N 0.00 0.00 -3.63 -0.14 4.71 -1.26 -4.68 120.64 115.64 2o5j n GLU 833 Ca 0.00 0.75 -0.16 0.00 -0.01 0.00 0.00 57.16 57.74 2o5j n GLU 833 Cb 0.00 -1.45 -0.14 0.00 -1.01 0.00 0.00 31.44 28.84 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 -2.81 -0.34 0.69 2.62 -4.23 -0.83 -5.09 115.64 105.66 2o5j s THR 834 Ca 0.00 0.23 -0.15 0.00 -1.18 0.00 0.00 61.69 60.59 2o5j s THR 834 Cb 0.00 -0.43 0.02 0.00 1.34 0.00 0.00 72.50 73.43 2o5j s THR 834 CO 0.00 0.07 1.16 -0.94 -0.54 0.00 0.00 174.62 174.37 2o5j s SER 835 N 2.35 4.64 0.62 3.99 1.04 -1.20 -4.78 113.70 120.37 2o5j s SER 835 Ca 0.03 2.19 0.26 0.00 0.48 0.00 0.00 55.95 58.91 2o5j s SER 835 Cb -0.13 -2.57 1.33 0.00 0.10 0.00 0.00 66.02 64.75 2o5j s SER 835 CO -0.08 -1.95 1.75 1.62 0.98 0.00 0.00 173.24 175.56 2o5j h VAL 836 N -0.11 0.17 -0.32 5.02 3.04 -1.80 0.45 116.25 122.70 2o5j h VAL 836 Ca -0.47 0.00 0.08 0.00 -1.01 0.00 0.00 66.70 65.30 2o5j h VAL 836 Cb 1.27 0.50 -0.01 0.00 -2.01 0.00 0.00 31.29 31.04 2o5j h VAL 836 CO 0.52 0.00 0.23 1.23 -1.01 0.00 0.00 177.57 178.54 2o5j h GLY 837 N 0.00 0.09 1.25 3.17 0.00 -1.54 -1.45 103.07 104.59 2o5j h GLY 837 Ca 0.16 -0.03 -0.25 0.00 0.00 0.00 0.00 47.33 47.22 2o5j h GLY 837 CO -0.00 0.02 -1.46 3.21 0.00 0.00 0.00 176.54 178.31 2o5j h ARG 838 N 0.07 0.00 -0.41 4.80 -0.00 -0.18 -3.28 114.38 115.38 2o5j h ARG 838 Ca 0.15 0.00 -0.10 0.00 -0.50 0.00 0.00 59.98 59.53 2o5j h ARG 838 Cb 0.52 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.47 2o5j h ARG 838 CO -0.01 0.57 -0.15 1.25 0.00 0.00 0.00 179.97 181.63 2o5j h LEU 839 N 0.00 0.84 -0.22 3.04 5.85 -1.26 -3.27 115.31 120.29 2o5j h LEU 839 Ca -0.19 -0.39 -0.04 0.00 0.84 0.00 0.00 57.88 58.10 2o5j h LEU 839 Cb 1.87 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.66 2o5j h LEU 839 CO 0.08 1.04 -0.02 0.50 -0.34 0.00 0.00 178.44 179.70 2o5j h LYS 840 N 0.64 0.40 -5.45 1.25 3.64 -1.45 -3.44 116.57 112.17 2o5j h LYS 840 Ca 0.10 -0.14 -0.68 0.00 -1.27 0.00 0.00 60.65 58.66 2o5j h LYS 840 Cb 0.70 -0.03 -0.31 0.00 -0.41 0.00 0.00 32.23 32.18 2o5j h LYS 840 CO 0.05 0.61 -0.85 0.71 -2.27 0.00 0.00 179.45 177.70 2o5j s TYR 841 N -4.89 2.60 -0.05 1.91 1.51 -1.23 -5.09 117.35 112.10 2o5j s TYR 841 Ca -0.14 -0.90 0.01 0.00 -1.01 0.00 0.00 57.07 55.04 2o5j s TYR 841 Cb 0.07 -1.72 0.02 0.00 -0.11 0.00 0.00 41.96 40.22 2o5j s TYR 841 CO 0.74 -0.33 -0.07 0.14 -1.11 0.00 0.00 175.55 174.92 2o5j s VAL 842 N 0.25 0.75 -0.14 0.71 -7.23 -1.26 -3.83 120.40 109.65 2o5j s VAL 842 Ca -0.15 -0.24 0.02 0.00 -1.81 0.00 0.00 61.98 59.80 2o5j s VAL 842 Cb -0.17 -0.74 0.01 0.00 0.56 0.00 0.00 36.38 36.05 2o5j s VAL 842 CO 0.07 0.27 -0.20 -0.36 -0.31 0.00 0.00 175.10 174.58 2o5j s PHE 843 N 0.88 2.52 0.00 2.82 0.40 -0.92 -5.05 117.98 118.63 2o5j s PHE 843 Ca -0.11 -1.28 0.00 0.00 -0.60 0.00 0.00 56.93 54.93 2o5j s PHE 843 Cb -0.15 -1.74 0.00 0.00 0.51 0.00 0.00 43.02 41.65 2o5j s PHE 843 CO 0.01 -0.60 0.00 0.00 0.70 0.00 0.00 175.22 175.32 2o5j n ALA 844 N 4.17 0.00 -1.27 5.36 0.00 -1.26 -1.43 120.51 126.08 2o5j n ALA 844 Ca -0.20 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 52.95 2o5j n ALA 844 Cb 0.51 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.10 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 -2.03 3.57 0.09 0.00 2.47 -1.26 -3.23 114.94 114.54 2o5j s ASN 845 Ca 0.00 1.42 -0.24 0.00 0.42 0.00 0.00 52.86 54.46 2o5j s ASN 845 Cb 0.00 -2.10 -0.15 0.00 -1.45 0.00 0.00 41.25 37.54 2o5j s ASN 845 CO 0.00 -2.57 1.73 -0.65 -3.72 0.00 0.00 177.10 171.89 2o5j h PRO 846 N -1.50 -0.10 -0.56 0.43 0.11 -1.89 -3.16 132.00 125.32 2o5j h PRO 846 Ca -0.49 0.01 0.11 0.00 0.11 0.00 0.00 66.00 65.74 2o5j h PRO 846 Cb 1.29 0.02 -0.10 0.00 0.11 0.00 0.00 31.00 32.32 2o5j h PRO 846 CO 0.56 -0.07 -0.07 -0.44 -0.21 0.00 0.00 178.00 177.77 2o5j h ASP 847 N -0.11 -0.39 -1.02 -2.05 5.19 -1.97 -1.59 116.42 114.48 2o5j h ASP 847 Ca -0.01 0.15 0.39 0.00 -0.62 0.00 0.00 57.03 56.94 2o5j h ASP 847 Cb 0.08 0.30 -0.17 0.00 0.18 0.00 0.00 39.33 39.73 2o5j h ASP 847 CO 0.02 -0.15 0.57 -0.33 -3.12 0.00 0.00 179.24 176.23 2o5j h GLU 848 N 0.05 0.11 -0.80 3.56 4.39 -1.93 0.19 114.58 120.14 2o5j h GLU 848 Ca 0.28 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.94 2o5j h GLU 848 Cb 0.44 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.03 2o5j h GLU 848 CO -0.53 0.07 0.36 0.00 -1.16 0.00 0.00 179.01 177.76 2o5j h ALA 849 N 1.93 1.03 0.00 3.43 0.00 -1.39 -3.05 119.26 121.21 2o5j h ALA 849 Ca 0.81 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 55.40 2o5j h ALA 849 Cb 2.09 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 19.54 2o5j h ALA 849 CO -0.69 0.62 -1.28 -0.07 0.00 0.00 0.00 179.25 177.82 2o5j h LEU 850 N 1.14 0.00 -1.51 0.00 4.07 -0.77 -3.24 115.31 114.99 2o5j h LEU 850 Ca 0.27 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.20 2o5j h LEU 850 Cb 0.15 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.89 2o5j h LEU 850 CO -0.03 0.54 -0.14 -0.07 -1.08 0.00 0.00 178.44 177.66 2o5j h LEU 851 N 0.00 0.00 -0.37 1.67 3.38 -1.32 -1.41 115.31 117.26 2o5j h LEU 851 Ca -0.14 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.67 2o5j h LEU 851 Cb 1.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.26 2o5j h LEU 851 CO 0.05 0.14 -0.79 0.00 0.09 0.00 0.00 178.44 177.93 2o5j h ALA 852 N 1.86 0.67 -0.29 1.53 0.00 -1.60 -3.06 119.26 118.36 2o5j h ALA 852 Ca -0.00 -0.71 -0.12 0.00 0.00 0.00 0.00 54.91 54.07 2o5j h ALA 852 Cb 0.54 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2o5j h ALA 852 CO 0.02 0.98 -0.30 0.28 0.00 0.00 0.00 179.25 180.23 2o5j h VAL 853 N 0.00 1.30 0.00 0.00 2.07 -1.33 -1.37 116.25 116.92 2o5j h VAL 853 Ca -0.01 -1.47 -0.03 0.00 0.82 0.00 0.00 66.70 66.02 2o5j h VAL 853 Cb 1.42 1.58 -0.00 0.00 -1.52 0.00 0.00 31.29 32.76 2o5j h VAL 853 CO 0.10 0.47 -0.13 0.00 0.02 0.00 0.00 177.57 178.03 2o5j h ALA 854 N 0.71 1.52 -0.02 1.67 0.00 -1.31 -2.26 119.26 119.57 2o5j h ALA 854 Ca 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2o5j h ALA 854 Cb 0.87 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2o5j h ALA 854 CO 0.07 0.16 -0.09 0.72 0.00 0.00 0.00 179.25 180.11 2o5j n HIS 855 N -3.99 0.00 -0.41 0.00 8.25 -1.16 -4.95 115.22 112.95 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 0.22 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.30 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 1.26 0.78 0.15 -1.41 0.00 -0.85 -4.98 105.19 100.14 2o5j n GLY 856 Ca 0.16 -0.09 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 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 1.38 -3.60 -0.61 1.08 -1.46 -3.46 117.51 110.84 2o5j h ILE 857 Ca 0.00 -2.34 -0.34 0.00 -0.39 0.00 0.00 64.86 61.79 2o5j h ILE 857 Cb 0.00 2.76 -0.32 0.00 -3.07 0.00 0.00 36.82 36.19 2o5j h ILE 857 CO 0.00 0.69 -0.75 0.68 -0.69 0.00 0.00 178.15 178.08 2o5j s VAL 858 N -2.95 0.25 0.68 1.67 -7.23 -1.23 -5.01 120.40 106.58 2o5j s VAL 858 Ca -0.12 -0.01 -0.14 0.00 -1.81 0.00 0.00 61.98 59.90 2o5j s VAL 858 Cb 0.04 -0.30 0.01 0.00 0.56 0.00 0.00 36.38 36.70 2o5j s VAL 858 CO 0.87 0.13 1.10 -1.81 -0.31 0.00 0.00 175.10 175.09 2o5j s ASP 859 N 0.67 4.98 0.54 4.85 -0.00 -1.26 -4.23 116.67 122.22 2o5j s ASP 859 Ca -0.07 1.96 0.32 0.00 -0.00 0.00 0.00 52.55 54.76 2o5j s ASP 859 Cb -0.10 -2.54 1.23 0.00 -0.00 0.00 0.00 42.92 41.51 2o5j s ASP 859 CO -0.01 -1.71 1.94 -0.07 -0.00 0.00 0.00 175.17 175.31 2o5j h LEU 860 N -0.23 0.00 -0.80 1.23 3.38 -1.94 -2.85 115.31 114.11 2o5j h LEU 860 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2o5j h LEU 860 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2o5j h LEU 860 CO 0.54 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.07 2o5j n GLN 861 N -3.10 1.55 -2.40 1.13 3.00 -1.26 -1.44 117.38 114.86 2o5j n GLN 861 Ca 0.01 -0.80 -0.29 0.00 -0.01 0.00 0.00 57.00 55.92 2o5j n GLN 861 Cb 0.34 -1.46 0.00 0.00 0.00 0.00 0.00 30.24 29.12 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 -1.90 6.26 -0.38 1.08 -0.00 -1.08 -2.09 116.67 118.56 2o5j s ASP 862 Ca 0.38 1.09 -0.18 0.00 -0.00 0.00 0.00 52.55 53.84 2o5j s ASP 862 Cb 0.20 -2.32 0.01 0.00 -0.00 0.00 0.00 42.92 40.81 2o5j s ASP 862 CO 0.32 -0.67 0.50 0.68 -0.00 0.00 0.00 175.17 176.01 2o5j s VAL 863 N -2.87 5.02 0.26 -1.27 -7.23 -1.26 -3.88 120.40 109.16 2o5j s VAL 863 Ca 0.50 0.11 0.02 0.00 -1.81 0.00 0.00 61.98 60.79 2o5j s VAL 863 Cb -0.11 -4.01 -0.05 0.00 0.56 0.00 0.00 36.38 32.77 2o5j s VAL 863 CO 0.47 -0.32 0.09 -0.69 -0.31 0.00 0.00 175.10 174.34 2o5j s VAL 864 N 2.37 0.63 -0.16 1.32 1.01 -1.26 -3.74 120.40 120.57 2o5j s VAL 864 Ca 0.17 -2.00 -0.07 0.00 0.00 0.00 0.00 61.98 60.08 2o5j s VAL 864 Cb -0.16 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 2o5j s VAL 864 CO 0.14 -0.03 0.09 0.42 0.00 0.00 0.00 175.10 175.72 2o5j s THR 865 N -3.70 5.03 0.01 3.92 -4.23 -1.25 -0.47 115.64 114.95 2o5j s THR 865 Ca 0.37 0.04 0.01 0.00 -1.18 0.00 0.00 61.69 60.93 2o5j s THR 865 Cb 0.08 -3.23 -0.01 0.00 1.34 0.00 0.00 72.50 70.67 2o5j s THR 865 CO 0.13 0.52 -0.03 -0.69 -0.54 0.00 0.00 174.62 174.01 2o5j s VAL 866 N -0.16 0.19 -0.51 2.29 1.01 0.18 -2.17 120.40 121.23 2o5j s VAL 866 Ca 0.08 -0.59 -0.21 0.00 0.00 0.00 0.00 61.98 61.27 2o5j s VAL 866 Cb -0.12 -0.26 0.05 0.00 0.00 0.00 0.00 36.38 36.05 2o5j s VAL 866 CO 0.01 -0.26 0.75 -0.60 0.00 0.00 0.00 175.10 175.00 2o5j s ARG 867 N -0.88 3.22 0.00 2.72 3.52 -0.51 -0.36 118.95 126.66 2o5j s ARG 867 Ca -0.08 -0.58 0.00 0.00 -0.13 0.00 0.00 55.73 54.94 2o5j s ARG 867 Cb -0.06 -4.06 0.00 0.00 -1.56 0.00 0.00 34.95 29.27 2o5j s ARG 867 CO -0.00 -1.29 0.00 0.98 -0.81 0.00 0.00 175.30 174.18 2o5j n TYR 868 N 6.66 -3.03 -0.43 5.12 -0.00 0.07 -4.35 117.16 121.20 2o5j n TYR 868 Ca -0.03 0.00 0.35 0.00 -0.00 0.00 0.00 57.90 58.23 2o5j n TYR 868 Cb 0.46 0.00 0.64 0.00 -0.00 0.00 0.00 39.34 40.45 2o5j n TYR 868 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.86 177.38 2o5j h MET 869 N 0.00 0.12 0.00 2.98 2.86 -1.98 -3.25 114.93 115.67 2o5j h MET 869 Ca 0.00 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2o5j h MET 869 Cb 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.63 2o5j h MET 869 CO 0.00 0.08 0.00 0.41 1.06 0.00 0.00 176.91 178.46 2o5j n GLY 870 N -1.55 0.63 3.11 8.32 0.00 -1.26 -5.13 105.19 109.32 2o5j n GLY 870 Ca 0.35 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.20 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 0.72 -0.81 1.61 1.02 -1.23 -5.08 119.74 115.97 2o5j s LYS 871 Ca 0.00 -0.76 -0.23 0.00 0.02 0.00 0.00 55.97 55.00 2o5j s LYS 871 Cb 0.00 -0.65 0.06 0.00 -0.52 0.00 0.00 37.83 36.72 2o5j s LYS 871 CO 0.00 0.15 1.20 1.03 -0.92 0.00 0.00 175.35 176.81 2o5j s ARG 872 N -1.35 3.33 -0.23 1.68 0.52 -1.26 -0.75 118.95 120.89 2o5j s ARG 872 Ca -0.03 -0.86 -0.09 0.00 -0.52 0.00 0.00 55.73 54.22 2o5j s ARG 872 Cb -0.09 -4.59 -0.04 0.00 0.52 0.00 0.00 34.95 30.75 2o5j s ARG 872 CO 0.01 -2.01 0.12 -0.51 0.02 0.00 0.00 175.30 172.94 2o5j s LEU 873 N 4.59 3.94 -1.03 2.53 1.43 0.52 -4.91 118.68 125.74 2o5j s LEU 873 Ca 0.33 0.05 -0.18 0.00 -1.03 0.00 0.00 54.13 53.31 2o5j s LEU 873 Cb -0.08 -2.04 0.13 0.00 0.03 0.00 0.00 46.19 44.23 2o5j s LEU 873 CO 0.04 0.07 1.26 -1.61 0.23 0.00 0.00 176.35 176.34 2o5j s GLU 874 N 1.00 3.75 -0.05 1.70 2.02 -1.26 0.50 118.70 126.36 2o5j s GLU 874 Ca 0.06 -1.95 -0.07 0.00 0.02 0.00 0.00 54.97 53.04 2o5j s GLU 874 Cb -0.14 -5.02 0.01 0.00 0.10 0.00 0.00 34.13 29.09 2o5j s GLU 874 CO 0.04 -1.83 0.18 0.99 0.02 0.00 0.00 175.26 174.66 2o5j s THR 875 N 2.63 0.02 0.80 3.63 2.01 0.38 -4.89 115.64 120.23 2o5j s THR 875 Ca 0.37 -0.16 -0.14 0.00 0.31 0.00 0.00 61.69 62.07 2o5j s THR 875 Cb -0.03 -0.31 0.02 0.00 0.01 0.00 0.00 72.50 72.19 2o5j s THR 875 CO -0.06 -0.09 0.77 -1.54 -0.69 0.00 0.00 174.62 173.01 2o5j n SER 876 N 2.60 -0.49 -0.28 3.53 3.41 -1.26 -4.17 113.62 116.96 2o5j n SER 876 Ca -0.15 0.54 -0.06 0.00 -0.26 0.00 0.00 58.87 58.94 2o5j n SER 876 Cb 0.58 -1.33 0.06 0.00 -0.26 0.00 0.00 64.21 63.26 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 -0.82 1.14 -0.66 4.33 0.11 -1.66 -2.62 132.00 131.81 2o5j h PRO 877 Ca -0.45 -0.19 0.02 0.00 0.11 0.00 0.00 66.00 65.48 2o5j h PRO 877 Cb 1.31 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 2o5j h PRO 877 CO 0.42 0.91 0.43 0.78 -0.21 0.00 0.00 178.00 180.33 2o5j h GLY 878 N 1.11 0.94 1.88 -0.55 0.00 -1.36 0.77 103.07 105.87 2o5j h GLY 878 Ca 0.26 -0.33 -0.08 0.00 0.00 0.00 0.00 47.33 47.18 2o5j h GLY 878 CO -0.03 0.31 -0.32 3.21 0.00 0.00 0.00 176.54 179.71 2o5j h ARG 879 N 0.86 0.14 -0.03 4.80 2.47 -1.64 -1.30 114.38 119.68 2o5j h ARG 879 Ca 0.25 -0.05 -0.20 0.00 -1.26 0.00 0.00 59.98 58.72 2o5j h ARG 879 Cb -0.05 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.26 2o5j h ARG 879 CO -0.07 0.45 -0.84 0.82 0.56 0.00 0.00 179.97 180.88 2o5j h ILE 880 N 0.12 1.40 -0.10 2.04 1.08 -1.03 -3.04 117.51 117.99 2o5j h ILE 880 Ca 0.02 -2.34 -0.02 0.00 -0.39 0.00 0.00 64.86 62.13 2o5j h ILE 880 Cb 0.63 2.29 -0.00 0.00 -3.07 0.00 0.00 36.82 36.67 2o5j h ILE 880 CO 0.05 0.70 -0.02 0.17 -0.69 0.00 0.00 178.15 178.35 2o5j h LEU 881 N 0.24 0.19 -0.91 1.44 8.10 -0.52 -2.78 115.31 121.06 2o5j h LEU 881 Ca -0.05 -0.37 0.16 0.00 0.11 0.00 0.00 57.88 57.72 2o5j h LEU 881 Cb 1.45 -0.05 -0.10 0.00 -0.44 0.00 0.00 40.66 41.52 2o5j h LEU 881 CO 0.14 0.52 0.51 0.15 -4.11 0.00 0.00 178.44 175.65 2o5j h PHE 882 N -0.14 0.89 -0.82 0.17 3.57 -1.31 0.14 116.94 119.44 2o5j h PHE 882 Ca 0.02 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.70 2o5j h PHE 882 Cb 0.44 -0.26 -0.09 0.00 2.79 0.00 0.00 35.95 38.83 2o5j h PHE 882 CO 0.05 0.22 0.40 0.00 -2.23 0.00 0.00 178.31 176.75 2o5j h ALA 883 N 1.59 1.21 0.09 2.41 0.00 -1.39 -1.82 119.26 121.34 2o5j h ALA 883 Ca 0.50 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.50 2o5j h ALA 883 Cb 0.73 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2o5j h ALA 883 CO -0.37 -0.12 -0.04 0.00 0.00 0.00 0.00 179.25 178.73 2o5j h ARG 884 N 0.58 -0.11 -0.65 0.00 3.08 -0.50 0.52 114.38 117.29 2o5j h ARG 884 Ca 0.45 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.62 2o5j h ARG 884 Cb 0.63 0.03 -0.12 0.00 0.08 0.00 0.00 29.97 30.59 2o5j h ARG 884 CO -0.37 0.28 -0.27 0.82 -1.07 0.00 0.00 179.97 179.36 2o5j h ILE 885 N -0.53 0.22 -0.03 2.04 2.04 -0.58 1.10 117.51 121.77 2o5j h ILE 885 Ca -0.01 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 2o5j h ILE 885 Cb 0.44 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 2o5j h ILE 885 CO 0.02 0.00 0.00 0.58 0.00 0.00 0.00 178.15 178.75 2o5j h VAL 886 N -0.09 1.22 -0.34 1.67 2.07 -1.38 0.12 116.25 119.51 2o5j h VAL 886 Ca 0.28 -0.65 0.10 0.00 0.82 0.00 0.00 66.70 67.25 2o5j h VAL 886 Cb 0.54 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.91 2o5j h VAL 886 CO -0.71 0.17 0.26 0.00 0.02 0.00 0.00 177.57 177.32 2o5j h ALA 887 N 0.74 2.25 0.00 1.67 0.00 0.45 -2.11 119.26 122.27 2o5j h ALA 887 Ca 0.01 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2o5j h ALA 887 Cb 0.28 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2o5j h ALA 887 CO 0.00 -0.44 -0.44 1.49 0.00 0.00 0.00 179.25 179.87 2o5j h GLU 888 N 0.00 0.00 -0.91 0.00 4.81 0.14 -3.30 114.58 115.32 2o5j h GLU 888 Ca 0.16 0.00 0.24 0.00 -0.13 0.00 0.00 59.36 59.64 2o5j h GLU 888 Cb 0.68 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.90 2o5j h GLU 888 CO -0.00 0.95 0.08 0.00 -0.73 0.00 0.00 179.01 179.30 2o5j h ALA 889 N -0.22 1.13 -3.58 2.92 0.00 -0.30 -3.24 119.26 115.96 2o5j h ALA 889 Ca -0.12 0.29 -0.63 0.00 0.00 0.00 0.00 54.91 54.45 2o5j h ALA 889 Cb 1.06 0.49 -0.39 0.00 0.00 0.00 0.00 17.79 18.95 2o5j h ALA 889 CO -0.07 -0.53 -0.75 0.14 0.00 0.00 0.00 179.25 178.04 2o5j s VAL 890 N -6.00 1.76 0.65 0.00 -7.23 -0.83 -4.63 120.40 104.12 2o5j s VAL 890 Ca -0.13 -1.75 0.17 0.00 -1.81 0.00 0.00 61.98 58.46 2o5j s VAL 890 Cb 0.27 -2.18 0.17 0.00 0.56 0.00 0.00 36.38 35.20 2o5j s VAL 890 CO 0.77 -0.41 1.52 -0.08 -0.31 0.00 0.00 175.10 176.59 2o5j h GLU 891 N 7.82 0.00 -4.95 4.82 4.57 -1.63 -3.32 114.58 121.90 2o5j h GLU 891 Ca -0.12 0.00 -0.67 0.00 -1.18 0.00 0.00 59.36 57.40 2o5j h GLU 891 Cb 1.04 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.57 2o5j h GLU 891 CO 0.47 0.00 2.53 -3.47 -1.18 0.00 0.00 179.01 177.36 2o5j n ASP 892 N -2.71 4.18 -0.27 1.04 4.64 -1.26 -4.75 116.55 117.41 2o5j n ASP 892 Ca -0.01 -2.85 0.08 0.00 -1.38 0.00 0.00 54.79 50.62 2o5j n ASP 892 Cb 0.64 -1.66 0.20 0.00 -1.04 0.00 0.00 41.12 39.25 2o5j n ASP 892 CO 0.00 0.00 0.00 -0.08 -0.82 0.00 0.00 177.20 176.30 2o5j h GLU 893 N 7.08 0.14 -0.80 -0.67 4.81 -1.75 0.17 114.58 123.56 2o5j h GLU 893 Ca 0.48 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.67 2o5j h GLU 893 Cb 0.76 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.08 2o5j h GLU 893 CO 1.66 0.09 0.37 0.87 -0.73 0.00 0.00 179.01 181.28 2o5j h LYS 894 N 0.14 1.16 0.00 1.92 1.57 -1.93 -0.34 116.57 119.09 2o5j h LYS 894 Ca 0.46 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2o5j h LYS 894 Cb 0.84 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.95 2o5j h LYS 894 CO -0.66 0.90 -0.02 0.28 -0.57 0.00 0.00 179.45 179.38 2o5j h VAL 895 N 1.14 0.08 -0.09 0.50 2.07 -1.14 -2.55 116.25 116.26 2o5j h VAL 895 Ca 0.27 -0.41 -0.13 0.00 0.82 0.00 0.00 66.70 67.26 2o5j h VAL 895 Cb 0.13 1.37 0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2o5j h VAL 895 CO -0.03 0.02 -0.43 0.00 0.02 0.00 0.00 177.57 177.15 2o5j h ALA 896 N 1.98 0.18 0.00 1.67 0.00 0.61 -3.21 119.26 120.49 2o5j h ALA 896 Ca -0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2o5j h ALA 896 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2o5j h ALA 896 CO 0.00 0.31 0.00 0.11 0.00 0.00 0.00 179.25 179.67 2o5j h TRP 897 N 0.02 0.00 -0.15 0.00 5.08 -1.20 -3.00 115.95 116.70 2o5j h TRP 897 Ca -0.03 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 59.83 2o5j h TRP 897 Cb 1.08 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.23 2o5j h TRP 897 CO 0.12 0.00 -0.41 1.49 -1.28 0.00 0.00 178.44 178.36 2o5j h GLU 898 N 0.00 0.34 -0.58 0.12 4.57 -1.49 -3.09 114.58 114.46 2o5j h GLU 898 Ca 0.00 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 2o5j h GLU 898 Cb 0.85 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 2o5j h GLU 898 CO 0.00 0.70 0.00 1.47 -1.18 0.00 0.00 179.01 180.00 2o5j n LEU 899 N -4.02 3.54 -4.34 1.64 -0.00 -1.20 -4.96 117.00 107.65 2o5j n LEU 899 Ca -0.02 -2.00 -0.29 0.00 -0.00 0.00 0.00 56.01 53.71 2o5j n LEU 899 Cb 0.49 -0.38 -0.14 0.00 -0.00 0.00 0.00 43.42 43.39 2o5j n LEU 899 CO 0.43 0.88 -0.56 0.27 -0.00 0.00 0.00 177.39 178.41 2o5j s ILE 900 N -1.00 2.11 -0.40 1.47 -4.36 -1.14 -4.75 121.20 113.13 2o5j s ILE 900 Ca 0.38 -1.47 -0.06 0.00 -0.26 0.00 0.00 60.65 59.25 2o5j s ILE 900 Cb 0.20 -1.82 0.09 0.00 1.25 0.00 0.00 42.46 42.17 2o5j s ILE 900 CO 0.26 0.27 0.21 0.00 0.24 0.00 0.00 174.94 175.92 2o5j s GLN 901 N -1.46 2.36 -0.17 0.37 -2.07 -1.26 -4.89 119.66 112.54 2o5j s GLN 901 Ca 0.12 -1.58 0.13 0.00 -1.82 0.00 0.00 55.36 52.21 2o5j s GLN 901 Cb -0.10 -3.64 0.68 0.00 -1.09 0.00 0.00 33.01 28.86 2o5j s GLN 901 CO 0.03 -0.96 1.55 1.47 -1.32 0.00 0.00 175.29 176.06 2o5j n LEU 902 N 4.76 4.76 -1.34 2.60 -0.00 -1.26 -4.25 117.00 122.27 2o5j n LEU 902 Ca -0.08 -2.41 0.10 0.00 -0.00 0.00 0.00 56.01 53.62 2o5j n LEU 902 Cb 0.42 -0.62 0.32 0.00 -0.00 0.00 0.00 43.42 43.54 2o5j n LEU 902 CO 0.35 0.62 0.77 0.47 -0.00 0.00 0.00 177.39 179.60 2o5j n ASP 903 N 0.67 4.09 -3.53 1.45 10.43 -1.26 -4.98 116.55 123.42 2o5j n ASP 903 Ca 0.23 -2.15 -0.11 0.00 2.57 0.00 0.00 54.79 55.33 2o5j n ASP 903 Cb 0.97 -0.49 -0.02 0.00 1.84 0.00 0.00 41.12 43.42 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 -1.29 0.01 0.29 2.53 -7.23 -1.26 -5.14 120.40 108.31 2o5j s VAL 904 Ca 0.47 -0.27 -0.29 0.00 -1.81 0.00 0.00 61.98 60.07 2o5j s VAL 904 Cb 0.26 -1.22 -0.10 0.00 0.56 0.00 0.00 36.38 35.89 2o5j s VAL 904 CO 0.29 -0.04 1.33 -2.84 -0.31 0.00 0.00 175.10 173.53 2o5j s PRO 905 N -3.79 4.35 -0.43 4.82 0.02 -1.26 -4.90 135.00 133.80 2o5j s PRO 905 Ca 0.03 2.20 -0.29 0.00 0.02 0.00 0.00 61.00 62.97 2o5j s PRO 905 Cb -0.01 -3.10 0.01 0.00 0.02 0.00 0.00 34.50 31.41 2o5j s PRO 905 CO -0.09 -0.24 1.46 -0.65 -0.33 0.00 0.00 177.00 177.15 2o5j s GLN 906 N -1.22 3.48 0.62 5.54 -1.52 -1.26 -4.95 119.66 120.35 2o5j s GLN 906 Ca 0.52 0.90 0.01 0.00 -1.95 0.00 0.00 55.36 54.84 2o5j s GLN 906 Cb -0.40 -4.07 0.07 0.00 -0.22 0.00 0.00 33.01 28.40 2o5j s GLN 906 CO 0.48 -1.69 0.86 -2.00 -0.25 0.00 0.00 175.29 172.69 2o5j s GLU 907 N 5.16 2.22 0.50 2.91 -6.30 -1.26 -4.12 118.70 117.80 2o5j s GLU 907 Ca 0.62 -0.94 0.17 0.00 -2.50 0.00 0.00 54.97 52.33 2o5j s GLU 907 Cb -0.14 -2.43 1.22 0.00 0.00 0.00 0.00 34.13 32.78 2o5j s GLU 907 CO 0.31 -0.99 2.06 -0.22 0.02 0.00 0.00 175.26 176.44 2o5j h LYS 908 N -0.15 0.13 0.10 4.30 3.64 -1.90 -1.77 116.57 120.92 2o5j h LYS 908 Ca -0.39 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 58.80 2o5j h LYS 908 Cb 1.29 -0.03 0.02 0.00 -0.41 0.00 0.00 32.23 33.10 2o5j h LYS 908 CO 0.47 0.09 -0.75 -0.91 -2.27 0.00 0.00 179.45 176.08 2o5j h ASN 909 N 0.13 0.48 -0.94 4.20 2.35 -1.97 0.57 115.58 120.40 2o5j h ASN 909 Ca 0.14 -0.90 0.08 0.00 -0.55 0.00 0.00 56.30 55.07 2o5j h ASN 909 Cb 0.40 -0.16 -0.07 0.00 0.05 0.00 0.00 38.32 38.55 2o5j h ASN 909 CO -0.02 1.34 0.61 0.28 -1.65 0.00 0.00 177.43 177.99 2o5j h SER 910 N -0.30 0.92 -0.04 5.81 0.02 -1.83 0.65 113.55 118.79 2o5j h SER 910 Ca -0.12 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.81 2o5j h SER 910 Cb 1.55 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.91 2o5j h SER 910 CO 0.14 0.57 -0.09 -0.07 -1.14 0.00 0.00 176.83 176.25 2o5j h LEU 911 N 1.04 0.15 -0.78 5.07 3.38 -1.33 -1.88 115.31 120.95 2o5j h LEU 911 Ca 0.42 -0.58 0.17 0.00 0.09 0.00 0.00 57.88 57.98 2o5j h LEU 911 Cb 0.27 -0.04 -0.11 0.00 0.09 0.00 0.00 40.66 40.87 2o5j h LEU 911 CO -0.17 0.70 0.23 0.50 0.09 0.00 0.00 178.44 179.79 2o5j h LYS 912 N -0.40 0.31 -0.75 1.13 3.64 0.61 0.89 116.57 122.00 2o5j h LYS 912 Ca 0.00 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 2o5j h LYS 912 Cb 0.68 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.39 2o5j h LYS 912 CO 0.02 0.20 0.31 -0.44 -2.27 0.00 0.00 179.45 177.27 2o5j h ASP 913 N 0.32 1.02 -0.23 4.20 3.45 -0.85 -2.66 116.42 121.66 2o5j h ASP 913 Ca 0.45 -0.16 -0.03 0.00 0.43 0.00 0.00 57.03 57.71 2o5j h ASP 913 Cb 0.78 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 39.27 2o5j h ASP 913 CO -0.51 0.90 0.03 0.25 -1.57 0.00 0.00 179.24 178.34 2o5j h LEU 914 N 1.07 0.38 0.01 1.55 6.46 -0.03 -1.53 115.31 123.21 2o5j h LEU 914 Ca 0.25 -0.27 0.02 0.00 -0.12 0.00 0.00 57.88 57.75 2o5j h LEU 914 Cb 0.19 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.00 2o5j h LEU 914 CO -0.02 0.56 -0.11 0.58 -0.62 0.00 0.00 178.44 178.82 2o5j h VAL 915 N 0.18 0.72 -0.15 1.05 2.07 -1.10 0.37 116.25 119.40 2o5j h VAL 915 Ca 0.07 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.64 2o5j h VAL 915 Cb 0.35 0.72 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 2o5j h VAL 915 CO 0.01 0.00 -0.26 0.22 0.02 0.00 0.00 177.57 177.55 2o5j h TYR 916 N -0.19 -0.71 -0.01 1.57 3.20 -1.42 0.30 116.97 119.70 2o5j h TYR 916 Ca 0.04 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.98 2o5j h TYR 916 Cb 0.24 0.34 -0.05 0.00 1.54 0.00 0.00 36.73 38.79 2o5j h TYR 916 CO -0.17 -0.34 -0.37 0.37 -1.64 0.00 0.00 178.16 176.00 2o5j h GLN 917 N -0.32 -0.51 -0.99 1.82 5.75 -1.10 -0.97 115.11 118.79 2o5j h GLN 917 Ca 0.11 0.03 0.20 0.00 -0.15 0.00 0.00 58.65 58.84 2o5j h GLN 917 Cb 0.48 0.12 -0.10 0.00 1.07 0.00 0.00 27.48 29.05 2o5j h GLN 917 CO -0.33 -0.34 0.62 0.00 -2.65 0.00 0.00 178.83 176.12 2o5j h ALA 918 N 0.11 1.81 0.74 3.38 0.00 -0.39 0.24 119.26 125.15 2o5j h ALA 918 Ca 0.06 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2o5j h ALA 918 Cb 0.61 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2o5j h ALA 918 CO -0.30 -0.17 -0.47 0.35 0.00 0.00 0.00 179.25 178.67 2o5j h PHE 919 N 0.68 -1.24 -0.10 0.00 3.57 0.90 -0.75 116.94 119.99 2o5j h PHE 919 Ca 0.56 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 62.04 2o5j h PHE 919 Cb 0.98 0.45 -0.00 0.00 2.79 0.00 0.00 35.95 40.17 2o5j h PHE 919 CO -0.00 -0.70 0.04 -0.07 -2.23 0.00 0.00 178.31 175.35 2o5j h LEU 920 N -1.14 0.14 0.69 0.59 3.38 -0.62 -2.55 115.31 115.81 2o5j h LEU 920 Ca -0.10 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 2o5j h LEU 920 Cb 0.92 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.64 2o5j h LEU 920 CO 0.09 0.27 -0.33 0.03 0.09 0.00 0.00 178.44 178.59 2o5j h ARG 921 N -0.00 -0.89 0.00 1.13 2.47 -0.56 -3.38 114.38 113.14 2o5j h ARG 921 Ca 0.03 0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.81 2o5j h ARG 921 Cb 0.18 0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 2o5j h ARG 921 CO -0.00 -0.58 -1.84 1.28 0.56 0.00 0.00 179.97 179.38 2o5j n LEU 922 N -5.40 0.14 0.00 3.04 4.77 -0.30 -5.06 117.00 114.19 2o5j n LEU 922 Ca -0.12 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 2o5j n LEU 922 Cb 0.37 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 2o5j n LEU 922 CO 0.29 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 2o5j n GLY 923 N 1.28 3.29 0.00 -0.72 0.00 -0.96 -4.79 105.19 103.29 2o5j n GLY 923 Ca -0.03 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.86 0.00 -0.25 1.61 0.00 -1.26 -2.08 117.12 114.27 2o5j n MET 924 Ca 0.00 0.40 0.15 0.00 -0.00 0.00 0.00 57.70 58.25 2o5j n MET 924 Cb 0.00 -1.19 0.44 0.00 0.00 0.00 0.00 33.22 32.47 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 0.54 -0.21 2.12 9.09 -1.94 0.10 114.58 124.29 2o5j h GLU 925 Ca 0.00 -0.03 -0.05 0.00 0.05 0.00 0.00 59.36 59.33 2o5j h GLU 925 Cb 0.00 -0.12 -0.01 0.00 -1.65 0.00 0.00 28.75 26.96 2o5j h GLU 925 CO 0.00 0.36 -0.08 -0.22 0.05 0.00 0.00 179.01 179.12 2o5j h LYS 926 N 0.56 0.33 -0.40 1.06 3.11 -1.86 -1.99 116.57 117.37 2o5j h LYS 926 Ca 0.46 -0.07 -0.09 0.00 -2.81 0.00 0.00 60.65 58.14 2o5j h LYS 926 Cb 0.92 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 32.09 2o5j h LYS 926 CO -0.20 0.42 -0.11 1.15 -2.81 0.00 0.00 179.45 177.90 2o5j h THR 927 N 0.31 1.28 -0.82 1.00 2.02 -0.25 -2.86 112.91 113.58 2o5j h THR 927 Ca 0.07 -1.21 0.14 0.00 0.77 0.00 0.00 66.41 66.17 2o5j h THR 927 Cb 0.35 1.23 -0.09 0.00 -1.74 0.00 0.00 68.15 67.90 2o5j h THR 927 CO 0.02 0.41 0.41 0.00 0.37 0.00 0.00 175.52 176.72 2o5j h ALA 928 N 0.84 1.21 -0.10 6.16 0.00 -0.68 0.89 119.26 127.58 2o5j h ALA 928 Ca 0.10 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.12 2o5j h ALA 928 Cb 0.64 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2o5j h ALA 928 CO 0.04 -0.10 -0.02 -0.09 0.00 0.00 0.00 179.25 179.08 2o5j h ARG 929 N 0.59 0.00 -0.77 0.00 2.43 -1.23 -2.13 114.38 113.27 2o5j h ARG 929 Ca 0.44 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.64 2o5j h ARG 929 Cb 0.62 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.12 2o5j h ARG 929 CO -0.36 0.00 0.51 1.25 -1.51 0.00 0.00 179.97 179.86 2o5j h LEU 930 N 0.00 0.83 0.34 3.80 5.85 -0.96 -0.69 115.31 124.48 2o5j h LEU 930 Ca 0.05 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2o5j h LEU 930 Cb 0.07 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 2o5j h LEU 930 CO -0.10 0.57 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.22 2o5j h LEU 931 N 0.96 -0.75 -0.69 2.25 3.38 -0.26 -0.90 115.31 119.30 2o5j h LEU 931 Ca 0.30 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.38 2o5j h LEU 931 Cb 0.02 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 2o5j h LEU 931 CO -0.09 -0.42 0.41 0.44 0.09 0.00 0.00 178.44 178.87 2o5j h ASP 932 N -0.64 0.64 0.06 -0.43 3.32 -1.11 -0.58 116.42 117.69 2o5j h ASP 932 Ca -0.02 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.06 2o5j h ASP 932 Cb 0.56 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.94 2o5j h ASP 932 CO -0.02 0.43 -0.48 0.00 -1.72 0.00 0.00 179.24 177.44 2o5j h ALA 933 N 1.32 -0.85 -0.49 3.45 0.00 -0.74 0.23 119.26 122.19 2o5j h ALA 933 Ca 0.29 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 2o5j h ALA 933 Cb 0.11 0.84 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 2o5j h ALA 933 CO -0.14 -1.06 0.18 -0.07 0.00 0.00 0.00 179.25 178.16 2o5j h LEU 934 N -0.67 0.64 -0.04 0.00 3.38 -1.01 -2.28 115.31 115.32 2o5j h LEU 934 Ca 0.02 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.94 2o5j h LEU 934 Cb 0.71 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2o5j h LEU 934 CO -0.31 0.59 -0.14 0.50 0.09 0.00 0.00 178.44 179.17 2o5j h LYS 935 N 0.70 -0.20 0.89 1.13 3.64 -0.21 0.11 116.57 122.63 2o5j h LYS 935 Ca 0.17 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2o5j h LYS 935 Cb 0.16 0.05 0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2o5j h LYS 935 CO -0.01 -0.14 -0.43 -0.92 -2.27 0.00 0.00 179.45 175.68 2o5j h TYR 936 N -0.21 -1.11 -0.17 1.91 -0.00 -0.21 -2.14 116.97 115.05 2o5j h TYR 936 Ca 0.06 -0.03 -0.08 0.00 -0.00 0.00 0.00 58.73 58.68 2o5j h TYR 936 Cb 0.29 0.37 -0.01 0.00 -0.00 0.00 0.00 36.73 37.38 2o5j h TYR 936 CO -0.22 -0.68 -0.26 1.88 -0.00 0.00 0.00 178.16 178.88 2o5j h TYR 937 N -1.25 0.35 -0.76 -3.82 -1.99 -1.46 -0.80 116.97 107.23 2o5j h TYR 937 Ca -0.12 -0.07 -0.02 0.00 2.00 0.00 0.00 58.73 60.52 2o5j h TYR 937 Cb 0.92 -0.09 -0.04 0.00 2.00 0.00 0.00 36.73 39.53 2o5j h TYR 937 CO -0.00 0.56 0.40 0.78 -0.00 0.00 0.00 178.16 179.90 2o5j h GLY 938 N 1.00 1.15 0.69 3.88 0.00 -0.74 -1.29 103.07 107.77 2o5j h GLY 938 Ca 0.04 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 2o5j h GLY 938 CO 0.04 0.51 -0.06 0.74 0.00 0.00 0.00 176.54 177.78 2o5j h PHE 939 N 1.06 -0.15 0.30 5.60 0.05 -0.89 -2.17 116.94 120.73 2o5j h PHE 939 Ca 0.27 -0.00 -0.01 0.00 3.82 0.00 0.00 57.97 62.05 2o5j h PHE 939 Cb 0.06 0.05 -0.02 0.00 2.00 0.00 0.00 35.95 38.04 2o5j h PHE 939 CO 0.00 0.16 -0.33 1.15 -0.18 0.00 0.00 178.31 179.12 2o5j h THR 940 N -0.47 0.00 -0.84 -1.55 2.02 -1.06 -2.37 112.91 108.63 2o5j h THR 940 Ca -0.02 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.40 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 0.03 0.00 0.60 -0.26 0.37 0.00 0.00 175.52 176.25 2o5j h PHE 941 N -0.63 0.12 -0.33 3.16 0.05 -1.34 -1.53 116.94 116.44 2o5j h PHE 941 Ca -0.04 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.74 2o5j h PHE 941 Cb 0.56 -0.04 -0.01 0.00 2.00 0.00 0.00 35.95 38.46 2o5j h PHE 941 CO -0.21 0.03 0.13 0.66 -0.18 0.00 0.00 178.31 178.74 2o5j h SER 942 N 0.09 0.46 -0.05 2.17 4.64 -0.87 0.48 113.55 120.47 2o5j h SER 942 Ca 0.41 -0.17 -0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2o5j h SER 942 Cb 1.49 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2o5j h SER 942 CO -0.04 0.50 0.02 0.71 -0.87 0.00 0.00 176.83 177.14 2o5j h THR 943 N 0.39 1.13 -0.57 2.95 1.35 -0.99 -3.22 112.91 113.95 2o5j h THR 943 Ca 0.11 -0.38 -0.09 0.00 -0.55 0.00 0.00 66.41 65.50 2o5j h THR 943 Cb 0.18 1.30 -0.02 0.00 -1.73 0.00 0.00 68.15 67.88 2o5j h THR 943 CO -0.01 0.11 0.00 0.71 -0.25 0.00 0.00 175.52 176.08 2o5j h THR 944 N -0.08 1.26 -0.79 6.82 1.35 -1.44 -2.92 112.91 117.11 2o5j h THR 944 Ca 0.02 -1.12 0.23 0.00 -0.55 0.00 0.00 66.41 64.98 2o5j h THR 944 Cb 0.15 0.86 -0.03 0.00 -1.73 0.00 0.00 68.15 67.40 2o5j h THR 944 CO -0.00 0.40 0.63 0.77 -0.25 0.00 0.00 175.52 177.07 2o5j h SER 945 N 0.89 0.00 -1.97 5.36 4.64 -0.91 -3.45 113.55 118.11 2o5j h SER 945 Ca 0.16 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.16 2o5j h SER 945 Cb 0.54 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.59 2o5j h SER 945 CO 0.03 0.00 -0.39 0.61 -0.87 0.00 0.00 176.83 176.21 2o5j n GLY 946 N -1.66 0.10 3.72 -0.77 0.00 -1.10 -4.96 105.19 100.51 2o5j n GLY 946 Ca 0.16 -0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.76 4.15 0.09 -0.61 -5.25 -1.26 -5.01 121.20 110.56 2o5j s ILE 947 Ca 0.00 1.59 -0.14 0.00 -0.99 0.00 0.00 60.65 61.11 2o5j s ILE 947 Cb 0.00 -4.02 0.02 0.00 2.95 0.00 0.00 42.46 41.42 2o5j s ILE 947 CO 0.00 0.15 0.33 0.42 -1.79 0.00 0.00 174.94 174.05 2o5j s THR 948 N 0.86 0.09 0.01 8.37 -4.23 -1.26 -5.08 115.64 114.39 2o5j s THR 948 Ca 0.56 -0.74 -0.23 0.00 -1.18 0.00 0.00 61.69 60.11 2o5j s THR 948 Cb -0.28 -1.15 -0.05 0.00 1.34 0.00 0.00 72.50 72.36 2o5j s THR 948 CO 0.30 -0.41 0.68 -0.63 -0.54 0.00 0.00 174.62 174.02 2o5j s ILE 949 N -3.46 4.84 0.02 2.99 -1.09 -1.26 -4.68 121.20 118.55 2o5j s ILE 949 Ca 0.01 1.44 0.00 0.00 -2.23 0.00 0.00 60.65 59.87 2o5j s ILE 949 Cb 0.02 -4.02 -0.01 0.00 -1.58 0.00 0.00 42.46 36.86 2o5j s ILE 949 CO -0.09 0.38 -0.03 -0.83 -1.23 0.00 0.00 174.94 173.14 2o5j s GLY 950 N -0.04 0.20 0.26 6.18 0.00 -1.26 -5.03 107.32 107.62 2o5j s GLY 950 Ca 0.35 -0.43 -0.03 0.00 0.00 0.00 0.00 44.72 44.60 2o5j s GLY 950 CO 0.20 -0.48 1.68 -2.22 0.00 0.00 0.00 173.10 172.27 2o5j h ILE 951 N 4.78 0.46 -0.44 0.90 1.08 -1.97 1.00 117.51 123.33 2o5j h ILE 951 Ca -0.30 -0.09 -0.09 0.00 -0.39 0.00 0.00 64.86 63.99 2o5j h ILE 951 Cb 1.21 0.18 -0.02 0.00 -3.07 0.00 0.00 36.82 35.12 2o5j h ILE 951 CO 0.44 0.05 -0.10 -0.78 -0.69 0.00 0.00 178.15 177.07 2o5j h ASP 952 N 0.26 0.78 -0.76 1.72 3.58 -2.01 -2.93 116.42 117.06 2o5j h ASP 952 Ca 0.45 -0.23 0.17 0.00 0.42 0.00 0.00 57.03 57.84 2o5j h ASP 952 Cb 0.81 -0.21 -0.14 0.00 1.72 0.00 0.00 39.33 41.52 2o5j h ASP 952 CO -0.55 0.91 -0.03 0.44 -2.88 0.00 0.00 179.24 177.13 2o5j h ASP 953 N 0.72 -0.42 -1.96 2.28 3.45 -1.18 -3.25 116.42 116.06 2o5j h ASP 953 Ca 0.12 0.20 -0.52 0.00 0.43 0.00 0.00 57.03 57.27 2o5j h ASP 953 Cb 0.58 0.37 -0.01 0.00 -0.56 0.00 0.00 39.33 39.71 2o5j h ASP 953 CO 0.04 -0.20 1.48 0.00 -1.57 0.00 0.00 179.24 178.99 2o5j s ALA 954 N -6.14 2.18 -0.23 3.45 0.00 -1.11 -4.79 121.76 115.13 2o5j s ALA 954 Ca -0.14 0.05 -0.08 0.00 0.00 0.00 0.00 51.96 51.80 2o5j s ALA 954 Cb 0.22 -4.23 -0.04 0.00 0.00 0.00 0.00 23.12 19.08 2o5j s ALA 954 CO 0.75 -3.69 0.09 0.08 0.00 0.00 0.00 175.76 172.99 2o5j s VAL 955 N 9.79 4.68 0.11 0.00 1.01 -1.23 -4.95 120.40 129.81 2o5j s VAL 955 Ca 0.88 -0.06 -0.27 0.00 0.00 0.00 0.00 61.98 62.53 2o5j s VAL 955 Cb -0.20 -3.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.95 2o5j s VAL 955 CO 0.28 0.37 0.84 -0.63 0.00 0.00 0.00 175.10 175.95 2o5j s ILE 956 N 1.17 4.52 0.34 2.22 1.01 -1.26 -4.88 121.20 124.32 2o5j s ILE 956 Ca 0.05 1.81 -0.26 0.00 0.00 0.00 0.00 60.65 62.25 2o5j s ILE 956 Cb -0.14 -4.20 -0.09 0.00 0.01 0.00 0.00 42.46 38.04 2o5j s ILE 956 CO 0.04 0.40 1.02 -2.84 0.00 0.00 0.00 174.94 173.56 2o5j s PRO 957 N -0.41 4.43 0.53 2.79 0.02 -1.26 -4.94 135.00 136.16 2o5j s PRO 957 Ca 0.40 1.51 0.31 0.00 0.02 0.00 0.00 61.00 63.25 2o5j s PRO 957 Cb -0.22 -2.79 1.28 0.00 0.02 0.00 0.00 34.50 32.78 2o5j s PRO 957 CO 0.26 0.10 1.95 1.49 -0.33 0.00 0.00 177.00 180.48 2o5j h GLU 958 N 3.06 0.00 0.00 5.54 4.57 -1.98 -2.12 114.58 123.65 2o5j h GLU 958 Ca -0.47 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 2o5j h GLU 958 Cb 1.21 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 2o5j h GLU 958 CO 0.64 0.05 0.00 1.05 -1.18 0.00 0.00 179.01 179.57 2o5j h GLU 959 N 0.00 0.00 -0.27 1.92 9.09 -1.99 -3.24 114.58 120.09 2o5j h GLU 959 Ca -0.00 0.00 0.06 0.00 0.05 0.00 0.00 59.36 59.47 2o5j h GLU 959 Cb 0.56 0.00 -0.08 0.00 -1.65 0.00 0.00 28.75 27.58 2o5j h GLU 959 CO 0.01 0.00 -0.39 -0.22 0.05 0.00 0.00 179.01 178.45 2o5j h LYS 960 N 0.00 -0.37 -0.79 1.06 3.64 -1.77 0.15 116.57 118.49 2o5j h LYS 960 Ca 0.00 0.03 0.14 0.00 -1.27 0.00 0.00 60.65 59.55 2o5j h LYS 960 Cb 0.73 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 32.58 2o5j h LYS 960 CO 0.00 -0.25 0.52 -0.22 -2.27 0.00 0.00 179.45 177.23 2o5j h LYS 961 N -0.38 0.50 0.25 1.90 3.64 -1.75 -1.59 116.57 119.13 2o5j h LYS 961 Ca 0.12 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2o5j h LYS 961 Cb 0.59 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2o5j h LYS 961 CO -0.48 0.33 -0.12 0.37 -2.27 0.00 0.00 179.45 177.28 2o5j h GLN 962 N 0.51 -0.32 -1.10 1.90 4.15 -1.19 -2.40 115.11 116.66 2o5j h GLN 962 Ca 0.39 0.02 0.30 0.00 0.77 0.00 0.00 58.65 60.13 2o5j h GLN 962 Cb 0.78 0.07 -0.09 0.00 0.21 0.00 0.00 27.48 28.45 2o5j h GLN 962 CO -0.14 -0.21 0.73 1.88 -1.93 0.00 0.00 178.83 179.16 2o5j h TYR 963 N -0.75 0.49 -0.11 3.99 -1.99 -0.68 0.56 116.97 118.47 2o5j h TYR 963 Ca -0.03 0.02 -0.05 0.00 2.00 0.00 0.00 58.73 60.66 2o5j h TYR 963 Cb 0.25 -0.14 -0.00 0.00 2.00 0.00 0.00 36.73 38.84 2o5j h TYR 963 CO 0.03 0.02 -0.13 -0.07 -0.00 0.00 0.00 178.16 178.01 2o5j h LEU 964 N 0.27 0.31 0.01 3.88 3.38 -1.36 -2.17 115.31 119.63 2o5j h LEU 964 Ca 0.61 -0.49 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2o5j h LEU 964 Cb 1.79 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.46 2o5j h LEU 964 CO -0.24 0.74 -0.01 -0.08 0.09 0.00 0.00 178.44 178.94 2o5j h GLU 965 N -0.12 -0.02 -0.57 1.13 4.57 -0.02 0.43 114.58 119.99 2o5j h GLU 965 Ca 0.02 0.00 0.11 0.00 -1.18 0.00 0.00 59.36 58.31 2o5j h GLU 965 Cb 0.66 0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 29.14 2o5j h GLU 965 CO 0.03 0.22 -0.18 0.93 -1.18 0.00 0.00 179.01 178.83 2o5j h GLU 966 N -0.25 -0.04 0.00 1.92 5.08 -0.12 0.22 114.58 121.40 2o5j h GLU 966 Ca -0.00 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 2o5j h GLU 966 Cb 0.24 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2o5j h GLU 966 CO 0.00 -0.02 -0.46 0.00 -1.00 0.00 0.00 179.01 177.52 2o5j h ALA 967 N 1.47 0.96 0.06 3.43 0.00 -1.32 -2.77 119.26 121.08 2o5j h ALA 967 Ca 0.27 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2o5j h ALA 967 Cb 0.45 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2o5j h ALA 967 CO -0.60 0.58 -0.03 -0.44 0.00 0.00 0.00 179.25 178.76 2o5j h ASP 968 N 0.00 -0.07 -0.81 0.00 5.19 0.28 -1.89 116.42 119.12 2o5j h ASP 968 Ca -0.00 -0.30 -0.01 0.00 -0.62 0.00 0.00 57.03 56.10 2o5j h ASP 968 Cb 1.00 0.02 -0.04 0.00 0.18 0.00 0.00 39.33 40.49 2o5j h ASP 968 CO 0.06 0.27 0.49 -0.09 -3.12 0.00 0.00 179.24 176.85 2o5j h ARG 969 N -0.42 1.11 0.00 3.56 2.43 -0.83 -1.76 114.38 118.47 2o5j h ARG 969 Ca -0.01 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 2o5j h ARG 969 Cb 0.37 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2o5j h ARG 969 CO 0.01 0.78 -0.10 -0.22 -1.51 0.00 0.00 179.97 178.93 2o5j h LYS 970 N 1.12 0.00 -0.69 0.20 3.64 -1.39 -1.07 116.57 118.39 2o5j h LYS 970 Ca 0.29 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.60 2o5j h LYS 970 Cb -0.04 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 2o5j h LYS 970 CO -0.05 0.10 0.13 1.25 -2.27 0.00 0.00 179.45 178.61 2o5j h LEU 971 N 0.00 1.07 -1.14 5.20 5.85 -0.48 -2.50 115.31 123.32 2o5j h LEU 971 Ca -0.00 -0.25 -0.07 0.00 0.84 0.00 0.00 57.88 58.40 2o5j h LEU 971 Cb 0.18 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 2o5j h LEU 971 CO 0.01 1.05 -0.10 0.25 -0.34 0.00 0.00 178.44 179.31 2o5j h LEU 972 N 1.05 0.46 -0.36 2.25 5.85 -1.03 -1.82 115.31 121.72 2o5j h LEU 972 Ca 0.21 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 2o5j h LEU 972 Cb 0.42 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 2o5j h LEU 972 CO 0.01 0.60 0.11 1.56 -0.34 0.00 0.00 178.44 180.38 2o5j h GLN 973 N 0.45 0.56 0.00 1.25 4.20 -1.00 -0.94 115.11 119.63 2o5j h GLN 973 Ca 0.09 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 2o5j h GLN 973 Cb 0.45 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2o5j h GLN 973 CO 0.02 0.59 -0.24 0.82 -0.67 0.00 0.00 178.83 179.35 2o5j h ILE 974 N 0.42 0.93 0.01 2.54 2.04 -1.14 0.31 117.51 122.62 2o5j h ILE 974 Ca 0.11 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 65.08 2o5j h ILE 974 Cb 0.27 1.51 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 2o5j h ILE 974 CO -0.00 0.23 -0.00 -0.33 0.00 0.00 0.00 178.15 178.05 2o5j h GLU 975 N 0.00 -0.01 -0.59 2.37 4.39 -1.01 -2.69 114.58 117.03 2o5j h GLU 975 Ca -0.00 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.72 2o5j h GLU 975 Cb 0.49 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.11 2o5j h GLU 975 CO 0.03 0.75 0.39 1.96 -1.16 0.00 0.00 179.01 180.98 2o5j h GLN 976 N -0.78 0.71 0.00 2.33 7.50 -1.01 0.63 115.11 124.49 2o5j h GLN 976 Ca -0.00 -0.04 -0.01 0.00 0.50 0.00 0.00 58.65 59.10 2o5j h GLN 976 Cb 0.76 -0.16 -0.00 0.00 0.05 0.00 0.00 27.48 28.13 2o5j h GLN 976 CO 0.00 0.47 -0.05 0.00 -1.50 0.00 0.00 178.83 177.75 2o5j h ALA 977 N 1.65 1.08 0.05 3.87 0.00 -0.97 -2.80 119.26 122.14 2o5j h ALA 977 Ca 0.23 -0.04 -0.30 0.00 0.00 0.00 0.00 54.91 54.80 2o5j h ALA 977 Cb 0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2o5j h ALA 977 CO -0.06 0.06 -1.65 0.98 0.00 0.00 0.00 179.25 178.58 2o5j n TYR 978 N -3.25 1.03 0.11 0.00 9.36 0.67 -2.52 117.16 122.55 2o5j n TYR 978 Ca -0.01 0.34 0.07 0.00 3.32 0.00 0.00 57.90 61.62 2o5j n TYR 978 Cb 0.23 -1.12 0.40 0.00 -0.63 0.00 0.00 39.34 38.22 2o5j n TYR 978 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 2o5j n GLU 979 N -4.03 0.09 -0.05 2.98 1.02 0.19 -1.05 120.64 119.79 2o5j n GLU 979 Ca -0.34 0.59 -0.05 0.00 -0.02 0.00 0.00 57.16 57.34 2o5j n GLU 979 Cb 0.84 -1.82 -0.14 0.00 -0.02 0.00 0.00 31.44 30.29 2o5j n GLU 979 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2o5j n MET 980 N -2.01 0.66 0.00 3.49 2.81 -1.07 -5.01 117.12 115.99 2o5j n MET 980 Ca -0.01 0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 2o5j n MET 980 Cb 0.04 -1.63 0.00 0.00 -0.71 0.00 0.00 33.22 30.92 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 1.59 1.24 0.22 3.03 0.00 -0.22 -5.04 105.19 106.01 2o5j n GLY 981 Ca -0.22 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.43 -3.35 1.61 0.04 -1.70 -3.45 116.94 109.67 2o5j h PHE 982 Ca 0.00 -0.01 -0.56 0.00 2.80 0.00 0.00 57.97 60.20 2o5j h PHE 982 Cb 0.00 0.14 -0.05 0.00 2.20 0.00 0.00 35.95 38.24 2o5j h PHE 982 CO 0.00 -0.13 0.05 -0.51 -0.60 0.00 0.00 178.31 177.12 2o5j s LEU 983 N -9.17 4.41 0.71 1.54 1.43 -1.19 -5.06 118.68 111.37 2o5j s LEU 983 Ca -0.11 1.24 -0.12 0.00 -1.03 0.00 0.00 54.13 54.11 2o5j s LEU 983 Cb 0.01 -3.03 0.02 0.00 0.03 0.00 0.00 46.19 43.23 2o5j s LEU 983 CO 0.36 0.05 1.09 0.28 0.23 0.00 0.00 176.35 178.36 2o5j s THR 984 N -0.02 3.40 0.38 5.49 -1.32 -1.26 -4.75 115.64 117.57 2o5j s THR 984 Ca 0.34 0.54 0.22 0.00 -1.21 0.00 0.00 61.69 61.58 2o5j s THR 984 Cb -0.19 -3.06 0.38 0.00 -1.51 0.00 0.00 72.50 68.12 2o5j s THR 984 CO 0.19 -0.52 1.60 -0.78 -2.21 0.00 0.00 174.62 172.90 2o5j h ASP 985 N -0.56 0.33 0.17 8.08 1.82 -1.99 -1.41 116.42 122.86 2o5j h ASP 985 Ca -0.45 0.22 -0.01 0.00 -0.39 0.00 0.00 57.03 56.40 2o5j h ASP 985 Cb 1.23 0.21 0.00 0.00 0.68 0.00 0.00 39.33 41.46 2o5j h ASP 985 CO 0.53 -0.33 -0.08 -0.09 -1.61 0.00 0.00 179.24 177.66 2o5j h ARG 986 N 0.07 -0.21 -1.00 0.28 2.43 -2.01 -3.27 114.38 110.68 2o5j h ARG 986 Ca 0.83 0.01 0.38 0.00 -0.81 0.00 0.00 59.98 60.39 2o5j h ARG 986 Cb 2.26 0.05 -0.18 0.00 -0.42 0.00 0.00 29.97 31.68 2o5j h ARG 986 CO -0.66 -0.14 0.46 0.93 -1.51 0.00 0.00 179.97 179.05 2o5j h GLU 987 N -0.91 0.05 0.00 0.20 5.08 -1.66 0.51 114.58 117.85 2o5j h GLU 987 Ca -0.02 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 2o5j h GLU 987 Cb 0.17 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.35 2o5j h GLU 987 CO 0.04 0.03 -0.53 -0.09 -1.00 0.00 0.00 179.01 177.46 2o5j h ARG 988 N 0.05 -0.64 0.50 2.33 2.43 -1.40 0.46 114.38 118.10 2o5j h ARG 988 Ca 0.79 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.98 2o5j h ARG 988 Cb 1.99 0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 31.67 2o5j h ARG 988 CO -0.77 -0.43 -0.40 -0.92 -1.51 0.00 0.00 179.97 175.94 2o5j h TYR 989 N -0.67 -1.10 -0.92 2.20 3.20 -0.08 -1.57 116.97 118.03 2o5j h TYR 989 Ca 0.02 0.00 0.21 0.00 3.14 0.00 0.00 58.73 62.09 2o5j h TYR 989 Cb 0.72 0.41 -0.07 0.00 1.54 0.00 0.00 36.73 39.33 2o5j h TYR 989 CO -0.51 -0.56 0.61 -0.44 -1.64 0.00 0.00 178.16 175.62 2o5j h ASP 990 N -0.87 0.43 -0.12 -2.11 5.19 -1.23 -0.82 116.42 116.89 2o5j h ASP 990 Ca -0.06 0.05 -0.23 0.00 -0.62 0.00 0.00 57.03 56.17 2o5j h ASP 990 Cb 0.73 -0.03 0.01 0.00 0.18 0.00 0.00 39.33 40.22 2o5j h ASP 990 CO 0.00 0.17 -0.81 1.56 -3.12 0.00 0.00 179.24 177.04 2o5j h GLN 991 N 0.43 0.77 -0.20 3.56 4.20 -0.70 -3.00 115.11 120.17 2o5j h GLN 991 Ca 0.49 -0.66 -0.01 0.00 0.06 0.00 0.00 58.65 58.52 2o5j h GLN 991 Cb 1.18 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 29.10 2o5j h GLN 991 CO -0.20 1.26 0.08 0.82 -0.67 0.00 0.00 178.83 180.12 2o5j h ILE 992 N 0.49 1.17 -0.60 2.54 2.04 -0.14 -2.48 117.51 120.52 2o5j h ILE 992 Ca -0.07 -0.51 0.09 0.00 1.00 0.00 0.00 64.86 65.38 2o5j h ILE 992 Cb 1.45 1.14 -0.07 0.00 -0.74 0.00 0.00 36.82 38.59 2o5j h ILE 992 CO 0.17 0.16 0.22 -0.07 0.00 0.00 0.00 178.15 178.63 2o5j h LEU 993 N 0.16 0.22 -1.20 1.44 3.38 -1.45 -1.26 115.31 116.59 2o5j h LEU 993 Ca 0.06 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 2o5j h LEU 993 Cb 0.18 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2o5j h LEU 993 CO -0.00 0.13 0.21 -0.61 0.09 0.00 0.00 178.44 178.25 2o5j h GLN 994 N 0.40 0.76 -0.27 1.13 5.75 -1.38 0.17 115.11 121.67 2o5j h GLN 994 Ca 0.30 -0.11 0.03 0.00 -0.15 0.00 0.00 58.65 58.72 2o5j h GLN 994 Cb 0.37 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.76 2o5j h GLN 994 CO -0.31 0.63 0.09 1.25 -2.65 0.00 0.00 178.83 177.84 2o5j h LEU 995 N 0.76 0.09 -0.01 -2.39 5.85 -0.77 -1.99 115.31 116.85 2o5j h LEU 995 Ca 0.18 0.03 -0.17 0.00 0.84 0.00 0.00 57.88 58.76 2o5j h LEU 995 Cb 0.16 0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.23 2o5j h LEU 995 CO -0.02 0.08 -0.67 -0.50 -0.34 0.00 0.00 178.44 176.99 2o5j h TRP 996 N 0.20 0.69 -1.12 1.25 4.06 -1.18 -0.38 115.95 119.48 2o5j h TRP 996 Ca 0.12 -0.37 0.31 0.00 2.06 0.00 0.00 58.89 61.01 2o5j h TRP 996 Cb 0.10 -0.08 -0.09 0.00 -1.00 0.00 0.00 29.16 28.08 2o5j h TRP 996 CO -0.14 1.19 0.73 1.15 -3.56 0.00 0.00 178.44 177.82 2o5j h THR 997 N -0.00 0.43 0.03 1.49 2.02 -0.57 0.89 112.91 117.21 2o5j h THR 997 Ca -0.08 -0.09 -0.14 0.00 0.77 0.00 0.00 66.41 66.86 2o5j h THR 997 Cb 1.37 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 2o5j h THR 997 CO 0.13 0.05 -0.74 -0.33 0.37 0.00 0.00 175.52 175.01 2o5j h GLU 998 N 0.27 0.07 -0.58 6.66 5.08 -1.34 -3.22 114.58 121.53 2o5j h GLU 998 Ca 0.63 -0.12 0.02 0.00 -1.00 0.00 0.00 59.36 58.88 2o5j h GLU 998 Cb 1.83 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 31.09 2o5j h GLU 998 CO -0.27 1.06 0.39 0.00 -1.00 0.00 0.00 179.01 179.19 2o5j h THR 999 N -0.81 1.12 0.02 1.13 1.03 0.75 0.14 112.91 116.29 2o5j h THR 999 Ca -0.18 -0.25 -0.00 0.00 -0.01 0.00 0.00 66.41 65.96 2o5j h THR 999 Cb 1.30 0.31 0.00 0.00 -1.07 0.00 0.00 68.15 68.69 2o5j h THR 999 CO -0.04 0.14 -0.01 0.00 -0.01 0.00 0.00 175.52 175.59 2o5j h THR 1000N 0.74 1.28 -0.44 0.00 1.03 0.55 -1.91 112.91 114.16 2o5j h THR 1000Ca 0.22 -0.94 0.13 0.00 -0.01 0.00 0.00 66.41 65.81 2o5j h THR 1000Cb -0.01 1.91 -0.02 0.00 -1.07 0.00 0.00 68.15 68.96 2o5j h THR 1000CO -0.05 0.24 0.32 -0.08 -0.01 0.00 0.00 175.52 175.94 2o5j h GLU 1001N -0.44 0.00 -0.02 0.00 4.22 -1.40 -0.56 114.58 116.38 2o5j h GLU 1001Ca -0.00 -0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 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 0.00 0.00 -0.01 0.87 -2.18 0.00 0.00 179.01 177.70 2o5j h LYS 1002N 0.00 0.05 -0.25 1.92 1.57 -0.49 -2.87 116.57 116.49 2o5j h LYS 1002Ca 0.21 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 2o5j h LYS 1002Cb 0.84 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 2o5j h LYS 1002CO -0.00 0.43 0.12 -0.24 -0.57 0.00 0.00 179.45 179.18 2o5j h VAL 1003N -0.34 1.09 0.12 0.50 3.04 -0.33 -2.06 116.25 118.27 2o5j h VAL 1003Ca 0.01 -0.25 -0.00 0.00 -1.01 0.00 0.00 66.70 65.44 2o5j h VAL 1003Cb 0.41 0.77 -0.00 0.00 -2.01 0.00 0.00 31.29 30.45 2o5j h VAL 1003CO 0.00 0.10 -0.10 0.74 -1.01 0.00 0.00 177.57 177.30 2o5j h THR 1004N 0.34 0.00 -0.79 3.17 2.02 -1.16 0.63 112.91 117.13 2o5j h THR 1004Ca 0.09 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.45 2o5j h THR 1004Cb 0.03 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.40 2o5j h THR 1004CO -0.01 0.00 0.54 -0.61 0.37 0.00 0.00 175.52 175.80 2o5j h GLN 1005N -0.22 0.27 0.88 6.66 5.75 -1.44 -1.89 115.11 125.13 2o5j h GLN 1005Ca -0.02 -0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.43 2o5j h GLN 1005Cb 0.18 -0.06 0.01 0.00 1.07 0.00 0.00 27.48 28.68 2o5j h GLN 1005CO -0.00 0.18 -0.42 0.00 -2.65 0.00 0.00 178.83 175.93 2o5j h ALA 1006N 1.63 -1.19 -0.65 3.38 0.00 -0.92 0.22 119.26 121.73 2o5j h ALA 1006Ca 0.39 -0.26 0.13 0.00 0.00 0.00 0.00 54.91 55.17 2o5j h ALA 1006Cb 1.12 0.46 -0.10 0.00 0.00 0.00 0.00 17.79 19.27 2o5j h ALA 1006CO -0.10 -1.16 0.13 0.28 0.00 0.00 0.00 179.25 178.39 2o5j h VAL 1007N -1.20 0.57 -0.60 0.00 2.07 -0.08 0.14 116.25 117.16 2o5j h VAL 1007Ca -0.12 -0.08 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 2o5j h VAL 1007Cb 0.91 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2o5j h VAL 1007CO 0.20 0.04 0.15 -0.26 0.02 0.00 0.00 177.57 177.73 2o5j h PHE 1008N 0.24 1.01 -0.50 1.57 0.05 -1.37 -2.46 116.94 115.48 2o5j h PHE 1008Ca 0.35 -0.12 0.05 0.00 3.82 0.00 0.00 57.97 62.07 2o5j h PHE 1008Cb 0.56 -0.29 -0.03 0.00 2.00 0.00 0.00 35.95 38.20 2o5j h PHE 1008CO -0.27 0.85 0.33 -0.22 -0.18 0.00 0.00 178.31 178.82 2o5j h LYS 1009N 0.88 0.47 0.46 1.51 3.64 0.20 0.48 116.57 124.20 2o5j h LYS 1009Ca 0.19 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 2o5j h LYS 1009Cb 0.35 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2o5j h LYS 1009CO 0.00 0.31 -0.22 -0.97 -2.27 0.00 0.00 179.45 176.30 2o5j h ASN 1010N 0.48 -0.52 0.07 4.20 -1.24 -0.57 -2.60 115.58 115.41 2o5j h ASN 1010Ca 0.21 -0.04 0.01 0.00 0.71 0.00 0.00 56.30 57.19 2o5j h ASN 1010Cb 0.22 0.13 -0.02 0.00 0.73 0.00 0.00 38.32 39.39 2o5j h ASN 1010CO -0.05 -0.29 -0.12 -0.26 -1.29 0.00 0.00 177.43 175.42 2o5j h PHE 1011N -0.72 -0.30 -0.62 0.67 0.04 -1.08 0.36 116.94 115.28 2o5j h PHE 1011Ca -0.06 0.01 0.13 0.00 2.80 0.00 0.00 57.97 60.84 2o5j h PHE 1011Cb 0.52 0.12 -0.11 0.00 2.20 0.00 0.00 35.95 38.69 2o5j h PHE 1011CO -0.02 -0.18 -0.08 1.49 -0.60 0.00 0.00 178.31 178.92 2o5j h GLU 1012N -0.23 0.05 0.00 1.51 4.81 -0.94 -0.85 114.58 118.92 2o5j h GLU 1012Ca 0.02 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.15 2o5j h GLU 1012Cb 0.25 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 2o5j h GLU 1012CO -0.07 0.03 -0.64 0.93 -0.73 0.00 0.00 179.01 178.53 2o5j h GLU 1013N 0.05 0.00 0.00 1.92 4.39 -1.36 -3.41 114.58 116.17 2o5j h GLU 1013Ca 0.31 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.99 2o5j h GLU 1013Cb 0.50 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.14 2o5j h GLU 1013CO -0.59 0.68 -0.31 -0.91 -1.16 0.00 0.00 179.01 176.72 2o5j h ASN 1014N -1.00 0.00 -3.19 1.42 2.35 -0.28 -3.43 115.58 111.44 2o5j h ASN 1014Ca -0.15 -0.13 -0.69 0.00 -0.55 0.00 0.00 56.30 54.78 2o5j h ASN 1014Cb 0.91 0.00 -0.37 0.00 0.05 0.00 0.00 38.32 38.91 2o5j h ASN 1014CO -0.09 0.73 -0.16 -1.22 -1.65 0.00 0.00 177.43 175.04 2o5j n TYR 1015N -4.67 3.98 0.16 1.19 4.01 -0.36 -4.91 117.16 116.56 2o5j n TYR 1015Ca -0.06 -4.11 0.08 0.00 -0.16 0.00 0.00 57.90 53.65 2o5j n TYR 1015Cb 0.20 -1.03 0.59 0.00 -0.31 0.00 0.00 39.34 38.79 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 0.14 -2.30 -0.72 0.11 -1.71 -2.98 132.00 130.30 2o5j h PRO 1016Ca 0.17 -0.01 -0.67 0.00 0.11 0.00 0.00 66.00 65.59 2o5j h PRO 1016Cb 0.78 -0.03 -0.37 0.00 0.11 0.00 0.00 31.00 31.49 2o5j h PRO 1016CO 0.85 0.10 -0.03 1.19 -0.21 0.00 0.00 178.00 179.90 2o5j n PHE 1017N -4.51 3.54 -2.93 0.65 0.99 -1.26 -4.88 117.46 109.05 2o5j n PHE 1017Ca 0.00 -3.48 -0.41 0.00 -0.00 0.00 0.00 57.45 53.56 2o5j n PHE 1017Cb 0.14 -0.76 -0.04 0.00 -1.00 0.00 0.00 39.48 37.82 2o5j n PHE 1017CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.76 177.97 2o5j s ASN 1018N -2.64 6.89 0.18 4.37 3.84 -1.13 -4.98 114.94 121.48 2o5j s ASN 1018Ca 0.44 1.10 -0.23 0.00 0.21 0.00 0.00 52.86 54.38 2o5j s ASN 1018Cb 0.23 -2.43 0.09 0.00 -0.55 0.00 0.00 41.25 38.59 2o5j s ASN 1018CO -0.12 -0.39 1.57 -0.65 -2.79 0.00 0.00 177.10 174.73 2o5j h PRO 1019N 7.39 -0.16 0.21 0.43 0.11 -1.89 -1.40 132.00 136.69 2o5j h PRO 1019Ca -0.29 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2o5j h PRO 1019Cb 1.13 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 2o5j h PRO 1019CO 0.83 -0.11 -0.22 1.25 -0.21 0.00 0.00 178.00 179.55 2o5j h LEU 1020N -0.17 -0.58 -0.18 2.35 6.46 -1.87 -3.16 115.31 118.17 2o5j h LEU 1020Ca 0.22 0.06 0.05 0.00 -0.12 0.00 0.00 57.88 58.09 2o5j h LEU 1020Cb 0.56 0.20 -0.06 0.00 -0.73 0.00 0.00 40.66 40.63 2o5j h LEU 1020CO -0.74 -0.32 -0.27 0.22 -0.62 0.00 0.00 178.44 176.71 2o5j h TYR 1021N -0.46 -0.72 -0.78 1.25 -0.00 -1.80 -2.95 116.97 111.51 2o5j h TYR 1021Ca 0.00 0.04 0.17 0.00 -0.00 0.00 0.00 58.73 58.93 2o5j h TYR 1021Cb 0.43 0.35 -0.11 0.00 -0.00 0.00 0.00 36.73 37.40 2o5j h TYR 1021CO -0.16 -0.35 0.28 0.28 -0.00 0.00 0.00 178.16 178.21 2o5j h VAL 1022N -0.31 0.56 -0.89 1.81 2.07 -1.24 -1.54 116.25 116.71 2o5j h VAL 1022Ca 0.11 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2o5j h VAL 1022Cb 0.49 0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 2o5j h VAL 1022CO -0.35 0.07 0.52 -0.03 0.02 0.00 0.00 177.57 177.79 2o5j h MET 1023N 0.37 1.22 -0.09 1.57 1.85 -1.56 0.15 114.93 118.43 2o5j h MET 1023Ca 0.45 -0.12 -0.08 0.00 -0.61 0.00 0.00 59.70 59.34 2o5j h MET 1023Cb 0.76 -0.25 0.00 0.00 0.43 0.00 0.00 31.60 32.54 2o5j h MET 1023CO -0.47 0.86 -0.24 0.00 -0.40 0.00 0.00 176.91 176.66 2o5j h ALA 1024N 1.28 0.15 0.20 0.39 0.00 0.09 0.86 119.26 122.24 2o5j h ALA 1024Ca 0.32 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2o5j h ALA 1024Cb -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2o5j h ALA 1024CO -0.06 0.13 -0.10 1.96 0.00 0.00 0.00 179.25 181.19 2o5j h GLN 1025N -0.14 -0.26 -7.17 0.00 1.08 -1.23 -3.42 115.11 103.96 2o5j h GLN 1025Ca -0.00 0.02 -0.54 0.00 -1.45 0.00 0.00 58.65 56.68 2o5j h GLN 1025Cb 0.85 0.06 0.16 0.00 -0.05 0.00 0.00 27.48 28.50 2o5j h GLN 1025CO 0.05 -0.08 0.40 -1.12 -0.95 0.00 0.00 178.83 177.13 2o5j s SER 1026N -5.05 4.23 0.00 1.46 0.01 0.50 -4.78 113.70 110.06 2o5j s SER 1026Ca -0.15 2.38 0.03 0.00 1.31 0.00 0.00 55.95 59.52 2o5j s SER 1026Cb 0.04 -2.59 0.15 0.00 0.21 0.00 0.00 66.02 63.83 2o5j s SER 1026CO 0.63 -2.24 0.47 0.61 0.41 0.00 0.00 173.24 173.12 2o5j n GLY 1027N 0.45 -0.16 0.00 3.44 0.00 -1.26 -4.31 105.19 103.35 2o5j n GLY 1027Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.75 0.00 -2.22 4.61 0.00 -1.13 -4.31 120.51 116.71 2o5j n ALA 1028Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.35 2o5j n ALA 1028Cb 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.36 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 0.84 0.00 0.00 1.81 0.28 -4.30 118.95 117.58 2o5j s ARG 1029Ca 0.00 -1.31 0.00 0.00 -1.72 0.00 0.00 55.73 52.70 2o5j s ARG 1029Cb 0.00 -0.25 0.00 0.00 -0.45 0.00 0.00 34.95 34.25 2o5j s ARG 1029CO 0.00 -0.00 0.00 0.41 -0.68 0.00 0.00 175.30 175.03 2o5j n GLY 1030N 0.04 3.14 2.88 -3.53 0.00 -1.26 -0.59 105.19 105.86 2o5j n GLY 1030Ca -0.13 -1.75 -0.17 0.00 0.00 0.00 0.00 46.02 43.97 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 0.61 0.26 1.61 3.84 -1.26 -4.78 114.94 115.22 2o5j s ASN 1031Ca 0.00 -0.07 -0.03 0.00 0.21 0.00 0.00 52.86 52.97 2o5j s ASN 1031Cb 0.00 -0.25 0.56 0.00 -0.55 0.00 0.00 41.25 41.00 2o5j s ASN 1031CO 0.00 -0.04 1.64 -0.65 -2.79 0.00 0.00 177.10 175.26 2o5j h PRO 1032N 6.91 0.15 0.00 0.43 0.11 -1.99 0.28 132.00 137.89 2o5j h PRO 1032Ca -0.38 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.66 2o5j h PRO 1032Cb 1.15 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2o5j h PRO 1032CO 0.48 0.10 -0.29 0.37 -0.21 0.00 0.00 178.00 178.46 2o5j h GLN 1033N 0.16 0.00 0.25 1.05 5.75 -1.98 -2.95 115.11 117.39 2o5j h GLN 1033Ca 0.47 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.96 2o5j h GLN 1033Cb 0.89 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.44 2o5j h GLN 1033CO -0.66 0.29 -0.12 1.96 -2.65 0.00 0.00 178.83 177.65 2o5j h GLN 1034N 0.00 -0.32 -1.03 1.69 4.20 -0.91 -3.19 115.11 115.56 2o5j h GLN 1034Ca -0.00 0.02 0.27 0.00 0.06 0.00 0.00 58.65 59.00 2o5j h GLN 1034Cb 0.66 0.07 -0.08 0.00 0.30 0.00 0.00 27.48 28.44 2o5j h GLN 1034CO 0.04 -0.03 0.69 0.82 -0.67 0.00 0.00 178.83 179.67 2o5j h ILE 1035N -1.00 0.53 -0.58 2.54 1.08 -1.04 0.14 117.51 119.18 2o5j h ILE 1035Ca -0.03 -0.10 -0.05 0.00 -0.39 0.00 0.00 64.86 64.29 2o5j h ILE 1035Cb 0.43 0.22 -0.03 0.00 -3.07 0.00 0.00 36.82 34.37 2o5j h ILE 1035CO 0.06 0.05 0.18 -0.09 -0.69 0.00 0.00 178.15 177.65 2o5j h ARG 1036N 0.29 0.88 0.00 2.37 2.43 -1.56 -1.77 114.38 117.02 2o5j h ARG 1036Ca 0.55 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 2o5j h ARG 1036Cb 1.60 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.01 2o5j h ARG 1036CO -0.20 0.76 0.00 1.96 -1.51 0.00 0.00 179.97 180.99 2o5j h GLN 1037N 0.86 0.00 0.00 0.20 4.20 -0.71 0.31 115.11 119.97 2o5j h GLN 1037Ca 0.19 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.56 2o5j h GLN 1037Cb 0.26 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.98 2o5j h GLN 1037CO -0.01 0.00 -1.99 1.28 -0.67 0.00 0.00 178.83 177.44 2o5j n LEU 1038N -2.61 1.93 -0.11 1.46 4.77 -0.89 -0.50 117.00 121.05 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 0.27 -0.85 -0.11 0.00 -2.33 0.00 0.00 43.42 40.40 2o5j n LEU 1038CO 0.23 0.38 -1.13 0.00 -1.33 0.00 0.00 177.39 175.55 2o5j n GLY 1040N 1.55 0.30 3.43 0.00 0.00 -0.12 -4.62 105.19 105.73 2o5j n GLY 1040Ca -0.45 -0.08 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.44 -0.40 0.99 2.34 0.92 -4.21 118.68 117.87 2o5j s LEU 1041Ca 0.00 1.15 -0.29 0.00 0.06 0.00 0.00 54.13 55.05 2o5j s LEU 1041Cb 0.00 1.78 0.01 0.00 -0.56 0.00 0.00 46.19 47.42 2o5j s LEU 1041CO 0.00 -0.21 1.41 -0.60 -1.06 0.00 0.00 176.35 175.89 2o5j s ARG 1042N 1.47 3.59 -0.18 1.48 3.52 -1.21 -4.71 118.95 122.92 2o5j s ARG 1042Ca -0.10 0.97 -0.13 0.00 -0.13 0.00 0.00 55.73 56.34 2o5j s ARG 1042Cb -0.07 -4.02 -0.22 0.00 -1.56 0.00 0.00 34.95 29.09 2o5j s ARG 1042CO -0.15 -1.54 0.22 0.41 -0.81 0.00 0.00 175.30 173.42 2o5j n GLY 1043N 5.03 -0.67 3.04 8.12 0.00 -1.26 -3.99 105.19 115.47 2o5j n GLY 1043Ca 0.16 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2o5j n GLY 1043CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2o5j s LEU 1044N -7.42 1.75 -0.24 0.99 1.43 -1.26 0.74 118.68 114.67 2o5j s LEU 1044Ca -0.27 -0.49 -0.01 0.00 -1.03 0.00 0.00 54.13 52.32 2o5j s LEU 1044Cb 0.07 -1.20 0.02 0.00 0.03 0.00 0.00 46.19 45.12 2o5j s LEU 1044CO 0.66 -0.03 -0.08 -0.04 0.23 0.00 0.00 176.35 177.10 2o5j s MET 1045N 1.31 2.86 0.81 1.70 -1.94 -1.26 -4.83 119.30 117.96 2o5j s MET 1045Ca 0.01 -0.95 -0.12 0.00 -1.71 0.00 0.00 55.69 52.92 2o5j s MET 1045Cb -0.13 -2.94 0.09 0.00 2.01 0.00 0.00 34.83 33.85 2o5j s MET 1045CO -0.08 -0.37 1.16 1.14 -0.01 0.00 0.00 175.02 176.85 2o5j s GLN 1046N 1.32 1.70 1.24 2.03 0.00 -1.26 -3.42 119.66 121.27 2o5j s GLN 1046Ca 0.01 1.56 -0.21 0.00 -0.00 0.00 0.00 55.36 56.72 2o5j s GLN 1046Cb -0.16 -1.80 0.31 0.00 0.00 0.00 0.00 33.01 31.35 2o5j s GLN 1046CO -0.05 -2.13 1.13 0.15 0.00 0.00 0.00 175.29 174.39 2o5j s LYS 1047N -4.40 -1.52 0.12 9.60 1.02 -0.77 -4.22 119.74 119.56 2o5j s LYS 1047Ca 0.69 -0.24 -0.24 0.00 0.02 0.00 0.00 55.97 56.20 2o5j s LYS 1047Cb -0.24 -1.58 -0.06 0.00 -0.52 0.00 0.00 37.83 35.43 2o5j s LYS 1047CO 0.52 -3.87 1.68 -1.35 -0.92 0.00 0.00 175.35 171.40 2o5j h PRO 1048N -2.69 -0.22 0.00 -1.68 0.11 -1.91 -3.28 132.00 122.33 2o5j h PRO 1048Ca -0.42 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2o5j h PRO 1048Cb 1.28 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2o5j h PRO 1048CO 0.28 -0.15 0.00 -1.13 -0.21 0.00 0.00 178.00 176.79 2o5j n SER 1049N -5.28 0.00 0.00 -2.05 3.41 -1.26 -4.92 113.62 103.52 2o5j n SER 1049Ca -0.05 0.89 0.00 0.00 -0.26 0.00 0.00 58.87 59.46 2o5j n SER 1049Cb 0.20 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 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 -0.93 0.08 3.61 5.00 0.00 -1.24 -5.10 105.19 106.61 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 -1.83 0.00 0.00 0.00 173.32 171.49 2o5j s GLU 1051N 0.00 3.33 0.77 1.61 -1.05 -1.26 -4.62 118.70 117.48 2o5j s GLU 1051Ca 0.00 2.01 -0.14 0.00 -0.15 0.00 0.00 54.97 56.68 2o5j s GLU 1051Cb 0.00 -4.30 0.05 0.00 -0.44 0.00 0.00 34.13 29.44 2o5j s GLU 1051CO 0.00 -1.88 1.16 2.41 0.95 0.00 0.00 175.26 177.90 2o5j n THR 1052N 7.34 2.58 -2.34 1.83 -1.04 -1.26 -1.86 114.28 119.54 2o5j n THR 1052Ca 0.27 -0.28 -0.34 0.00 -2.04 0.00 0.00 64.05 61.66 2o5j n THR 1052Cb 0.45 -1.22 -0.01 0.00 -1.82 0.00 0.00 70.33 67.73 2o5j n THR 1052CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 2o5j s PHE 1053N -1.96 2.85 0.24 -1.42 5.36 -1.22 -4.70 117.98 117.13 2o5j s PHE 1053Ca 0.75 1.56 -0.00 0.00 -0.96 0.00 0.00 56.93 58.27 2o5j s PHE 1053Cb -0.31 -3.15 0.26 0.00 -0.34 0.00 0.00 43.02 39.48 2o5j s PHE 1053CO 0.49 -1.19 1.62 1.49 -1.46 0.00 0.00 175.22 176.17 2o5j h GLU 1054N 1.22 0.52 -5.75 10.12 4.81 -1.93 -3.43 114.58 120.13 2o5j h GLU 1054Ca -0.49 -0.25 -0.61 0.00 -0.13 0.00 0.00 59.36 57.88 2o5j h GLU 1054Cb 1.24 -0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.54 2o5j h GLU 1054CO 0.58 0.82 -0.29 0.14 -0.73 0.00 0.00 179.01 179.53 2o5j s VAL 1055N -4.26 5.22 0.73 0.32 -7.23 -1.26 -5.03 120.40 108.89 2o5j s VAL 1055Ca -0.07 0.64 -0.01 0.00 -1.81 0.00 0.00 61.98 60.73 2o5j s VAL 1055Cb 0.13 -3.64 0.13 0.00 0.56 0.00 0.00 36.38 33.56 2o5j s VAL 1055CO 0.81 0.50 1.01 -2.84 -0.31 0.00 0.00 175.10 174.27 2o5j s PRO 1056N -0.41 1.63 -0.97 4.82 0.02 -1.26 -4.77 135.00 134.06 2o5j s PRO 1056Ca 0.20 -1.10 -0.08 0.00 0.02 0.00 0.00 61.00 60.03 2o5j s PRO 1056Cb -0.14 -2.31 0.25 0.00 0.02 0.00 0.00 34.50 32.31 2o5j s PRO 1056CO 0.08 -1.49 0.92 0.08 -0.33 0.00 0.00 177.00 176.26 2o5j s VAL 1057N -3.17 5.42 0.38 3.83 1.01 0.23 -4.93 120.40 123.17 2o5j s VAL 1057Ca 0.67 -3.27 0.21 0.00 0.00 0.00 0.00 61.98 59.59 2o5j s VAL 1057Cb -0.05 -4.31 0.21 0.00 0.00 0.00 0.00 36.38 32.23 2o5j s VAL 1057CO 0.45 -1.11 1.60 0.03 0.00 0.00 0.00 175.10 176.07 2o5j h ARG 1058N 6.81 0.00 -6.64 2.72 3.08 -1.86 -3.37 114.38 115.12 2o5j h ARG 1058Ca 0.15 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.76 2o5j h ARG 1058Cb 0.90 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.99 2o5j h ARG 1058CO 0.90 0.00 -0.15 -1.54 -1.07 0.00 0.00 179.97 178.11 2o5j s SER 1059N -3.91 5.57 0.49 7.04 1.04 -1.26 -4.89 113.70 117.78 2o5j s SER 1059Ca -0.02 -0.09 0.05 0.00 0.48 0.00 0.00 55.95 56.37 2o5j s SER 1059Cb 0.06 -0.99 -0.01 0.00 0.10 0.00 0.00 66.02 65.18 2o5j s SER 1059CO 0.19 -0.87 0.20 -0.44 0.98 0.00 0.00 173.24 173.31 2o5j s SER 1060N -4.33 4.39 0.21 7.02 0.01 -1.26 -3.31 113.70 116.42 2o5j s SER 1060Ca 0.53 -1.33 0.25 0.00 1.31 0.00 0.00 55.95 56.72 2o5j s SER 1060Cb -0.10 0.16 0.61 0.00 0.21 0.00 0.00 66.02 66.90 2o5j s SER 1060CO 0.36 -0.84 1.61 -0.26 0.41 0.00 0.00 173.24 174.52 2o5j h PHE 1061N 1.17 0.00 0.56 2.43 -1.00 -0.76 -3.30 116.94 116.03 2o5j h PHE 1061Ca -0.41 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.35 2o5j h PHE 1061Cb 1.29 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.85 2o5j h PHE 1061CO 1.04 0.00 -0.31 -0.09 -1.61 0.00 0.00 178.31 177.34 2o5j h ARG 1062N 0.00 -0.77 -6.59 1.51 1.12 -1.71 -3.43 114.38 104.51 2o5j h ARG 1062Ca 0.00 0.05 -0.47 0.00 -1.11 0.00 0.00 59.98 58.45 2o5j h ARG 1062Cb 0.77 0.18 0.02 0.00 -0.01 0.00 0.00 29.97 30.92 2o5j h ARG 1062CO 0.00 -0.52 -0.15 -1.83 -3.11 0.00 0.00 179.97 174.36 2o5j s GLU 1063N -6.06 3.38 -0.34 0.20 -1.05 -1.24 -4.99 118.70 108.60 2o5j s GLU 1063Ca -0.17 -0.35 -0.31 0.00 -0.15 0.00 0.00 54.97 53.99 2o5j s GLU 1063Cb 0.04 -2.62 -0.09 0.00 -0.44 0.00 0.00 34.13 31.03 2o5j s GLU 1063CO 0.63 0.02 2.25 0.41 0.95 0.00 0.00 175.26 179.52 2o5j n GLY 1064N -1.89 0.64 3.68 -3.83 0.00 -1.26 -4.46 105.19 98.06 2o5j n GLY 1064Ca -0.03 0.84 -0.42 0.00 0.00 0.00 0.00 46.02 46.41 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 8.44 4.38 1.29 0.99 2.96 -1.26 -4.90 118.68 130.58 2o5j s LEU 1065Ca 1.06 2.55 -0.18 0.00 -0.22 0.00 0.00 54.13 57.34 2o5j s LEU 1065Cb -0.57 -3.55 0.33 0.00 0.50 0.00 0.00 46.19 42.90 2o5j s LEU 1065CO 0.40 -0.96 0.98 0.28 -1.32 0.00 0.00 176.35 175.73 2o5j s THR 1066N 3.38 1.61 0.37 3.68 -1.32 -1.26 -4.92 115.64 117.19 2o5j s THR 1066Ca 0.79 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 61.32 2o5j s THR 1066Cb -0.41 -2.09 0.27 0.00 -1.51 0.00 0.00 72.50 68.77 2o5j s THR 1066CO 0.35 0.00 2.02 0.58 -2.21 0.00 0.00 174.62 175.36 2o5j h VAL 1067N -3.02 1.12 0.00 5.08 2.07 -2.04 -3.35 116.25 116.11 2o5j h VAL 1067Ca -0.53 -0.25 -0.40 0.00 0.82 0.00 0.00 66.70 66.34 2o5j h VAL 1067Cb 1.34 0.32 -0.06 0.00 -1.52 0.00 0.00 31.29 31.37 2o5j h VAL 1067CO 0.40 0.13 -2.37 0.18 0.02 0.00 0.00 177.57 175.93 2o5j n LEU 1068N -4.46 2.14 -0.01 2.57 4.77 -1.26 -4.47 117.00 116.27 2o5j n LEU 1068Ca 0.06 0.17 0.22 0.00 -0.03 0.00 0.00 56.01 56.43 2o5j n LEU 1068Cb 0.08 -0.76 0.54 0.00 -2.33 0.00 0.00 43.42 40.95 2o5j n LEU 1068CO 0.35 0.64 1.20 -0.33 -1.33 0.00 0.00 177.39 177.92 2o5j h GLU 1069N -0.62 0.00 -0.07 3.23 5.08 -1.95 0.19 114.58 120.44 2o5j h GLU 1069Ca -0.60 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.74 2o5j h GLU 1069Cb 1.63 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.88 2o5j h GLU 1069CO -0.29 0.00 -0.02 -0.92 -1.00 0.00 0.00 179.01 176.78 2o5j h TYR 1070N 0.00 0.15 -0.96 4.33 -0.00 -1.78 -2.66 116.97 116.05 2o5j h TYR 1070Ca 0.30 -0.04 0.15 0.00 -0.00 0.00 0.00 58.73 59.14 2o5j h TYR 1070Cb 2.03 -0.04 -0.08 0.00 -0.00 0.00 0.00 36.73 38.64 2o5j h TYR 1070CO 0.00 0.49 0.61 0.35 -0.00 0.00 0.00 178.16 179.61 2o5j h PHE 1071N -0.23 0.99 -0.26 -3.82 3.04 -0.85 0.60 116.94 116.41 2o5j h PHE 1071Ca 0.02 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.89 2o5j h PHE 1071Cb 0.44 -0.31 -0.00 0.00 2.56 0.00 0.00 35.95 38.64 2o5j h PHE 1071CO 0.06 0.34 -0.25 0.82 -2.02 0.00 0.00 178.31 177.27 2o5j h ILE 1072N 0.82 1.31 -0.79 1.41 1.08 -1.53 -3.03 117.51 116.78 2o5j h ILE 1072Ca 0.50 -1.41 -0.03 0.00 -0.39 0.00 0.00 64.86 63.53 2o5j h ILE 1072Cb 0.69 1.63 -0.04 0.00 -3.07 0.00 0.00 36.82 36.03 2o5j h ILE 1072CO -0.26 0.44 0.38 0.28 -0.69 0.00 0.00 178.15 178.30 2o5j h SER 1073N 0.35 1.02 -0.94 1.72 0.02 -0.62 -2.85 113.55 112.25 2o5j h SER 1073Ca 0.04 -0.12 0.22 0.00 -0.84 0.00 0.00 61.79 61.10 2o5j h SER 1073Cb 0.81 -0.26 -0.07 0.00 0.14 0.00 0.00 62.40 63.01 2o5j h SER 1073CO 0.06 0.86 0.62 -1.28 -1.14 0.00 0.00 176.83 175.96 2o5j h SER 1074N 1.12 0.40 -0.76 3.07 0.87 0.22 0.20 113.55 118.67 2o5j h SER 1074Ca 0.27 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.88 2o5j h SER 1074Cb 0.11 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.01 2o5j h SER 1074CO -0.04 0.14 0.45 0.45 -0.53 0.00 0.00 176.83 177.30 2o5j h HIS 1075N 0.39 1.01 0.00 2.24 3.86 -1.51 -2.06 115.15 119.07 2o5j h HIS 1075Ca 0.50 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.69 2o5j h HIS 1075Cb 1.29 -0.33 -0.00 0.00 1.06 0.00 0.00 27.41 29.42 2o5j h HIS 1075CO -0.00 0.69 -0.04 0.78 0.86 0.00 0.00 177.93 180.21 2o5j h GLY 1076N 1.04 0.00 1.10 2.45 0.00 -1.09 -2.43 103.07 104.14 2o5j h GLY 1076Ca 0.27 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.27 2o5j h GLY 1076CO -0.05 0.00 -1.54 0.00 0.00 0.00 0.00 176.54 174.95 2o5j h ALA 1077N 1.96 -0.05 -0.26 3.60 0.00 -1.31 -3.28 119.26 119.92 2o5j h ALA 1077Ca -0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 54.91 53.94 2o5j h ALA 1077Cb 0.12 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2o5j h ALA 1077CO 0.01 0.78 0.07 0.00 0.00 0.00 0.00 179.25 180.11 2o5j h ARG 1078N 0.09 0.41 -0.66 0.00 2.47 -1.16 -2.66 114.38 112.88 2o5j h ARG 1078Ca -0.28 -0.09 0.16 0.00 -1.26 0.00 0.00 59.98 58.51 2o5j h ARG 1078Cb 2.11 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 30.34 2o5j h ARG 1078CO 0.23 0.50 0.46 -0.22 0.56 0.00 0.00 179.97 181.50 2o5j h LYS 1079N 0.25 0.16 0.05 0.04 3.64 -1.59 -1.99 116.57 117.15 2o5j h LYS 1079Ca 0.08 -0.01 -0.27 0.00 -1.27 0.00 0.00 60.65 59.18 2o5j h LYS 1079Cb 0.26 -0.04 0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2o5j h LYS 1079CO -0.00 0.11 -1.10 0.78 -2.27 0.00 0.00 179.45 176.97 2o5j h GLY 1080N 0.17 0.73 0.77 5.01 0.00 -1.54 -3.28 103.07 104.92 2o5j h GLY 1080Ca 0.32 -1.38 0.03 0.00 0.00 0.00 0.00 47.33 46.30 2o5j h GLY 1080CO -0.05 1.22 0.13 -1.33 0.00 0.00 0.00 176.54 176.51 2o5j h GLY 1081N 0.30 0.42 1.59 4.60 0.00 -1.04 -2.01 103.07 106.92 2o5j h GLY 1081Ca -0.15 -0.08 -0.11 0.00 0.00 0.00 0.00 47.33 46.99 2o5j h GLY 1081CO 0.21 0.05 -0.31 0.00 0.00 0.00 0.00 176.54 176.49 2o5j h ALA 1082N 1.19 1.04 -0.06 3.60 0.00 -1.70 -3.14 119.26 120.18 2o5j h ALA 1082Ca 0.14 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.71 2o5j h ALA 1082Cb 0.09 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 2o5j h ALA 1082CO -0.13 0.59 -0.24 0.22 0.00 0.00 0.00 179.25 179.69 2o5j h ASP 1083N 0.40 -0.72 -0.86 0.00 3.58 -1.51 -1.83 116.42 115.48 2o5j h ASP 1083Ca 0.05 0.11 0.14 0.00 0.42 0.00 0.00 57.03 57.74 2o5j h ASP 1083Cb 0.75 0.31 -0.06 0.00 1.72 0.00 0.00 39.33 42.04 2o5j h ASP 1083CO 0.06 -0.30 0.56 0.00 -2.88 0.00 0.00 179.24 176.68 2o5j h THR 1084N -0.34 0.85 0.53 2.25 1.03 -1.33 0.46 112.91 116.36 2o5j h THR 1084Ca 0.08 -0.23 -0.02 0.00 -0.01 0.00 0.00 66.41 66.24 2o5j h THR 1084Cb 0.45 0.13 -0.01 0.00 -1.07 0.00 0.00 68.15 67.65 2o5j h THR 1084CO -0.26 0.12 -0.42 0.00 -0.01 0.00 0.00 175.52 174.95 2o5j h ALA 1085N 1.60 -0.99 -0.65 0.00 0.00 -1.40 0.76 119.26 118.58 2o5j h ALA 1085Ca 0.42 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2o5j h ALA 1085Cb 0.70 0.57 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 2o5j h ALA 1085CO -0.18 -1.09 0.30 -0.07 0.00 0.00 0.00 179.25 178.21 2o5j h LEU 1086N -0.94 0.83 -0.76 0.00 4.07 -1.19 -2.34 115.31 114.98 2o5j h LEU 1086Ca -0.06 -0.09 -0.12 0.00 0.08 0.00 0.00 57.88 57.69 2o5j h LEU 1086Cb 0.80 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 2o5j h LEU 1086CO 0.00 0.72 -0.36 0.03 -1.08 0.00 0.00 178.44 177.75 2o5j h ARG 1087N 0.92 0.53 0.00 1.13 2.47 -0.52 -2.13 114.38 116.77 2o5j h ARG 1087Ca 0.22 -0.25 -0.09 0.00 -1.26 0.00 0.00 59.98 58.61 2o5j h ARG 1087Cb 0.11 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.42 2o5j h ARG 1087CO -0.03 0.81 -0.42 1.79 0.56 0.00 0.00 179.97 182.69 2o5j h THR 1088N 0.45 1.18 -0.01 2.04 1.35 0.97 -2.04 112.91 116.85 2o5j h THR 1088Ca 0.05 -1.49 -0.15 0.00 -0.55 0.00 0.00 66.41 64.27 2o5j h THR 1088Cb 0.83 1.83 -0.02 0.00 -1.73 0.00 0.00 68.15 69.06 2o5j h THR 1088CO 0.07 0.41 -0.68 0.00 -0.25 0.00 0.00 175.52 175.07 2o5j h ALA 1089N 1.58 0.86 -0.00 6.62 0.00 -0.92 -2.98 119.26 124.43 2o5j h ALA 1089Ca -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2o5j h ALA 1089Cb 0.80 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2o5j h ALA 1089CO 0.05 0.84 -0.55 -0.25 0.00 0.00 0.00 179.25 179.34 2o5j n ASP 1090N -3.74 0.60 0.04 0.00 9.92 -0.85 -1.81 116.55 120.71 2o5j n ASP 1090Ca -0.01 -0.39 -0.18 0.00 -0.53 0.00 0.00 54.79 53.68 2o5j n ASP 1090Cb 0.67 0.34 -0.09 0.00 -0.64 0.00 0.00 41.12 41.41 2o5j n ASP 1090CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 2o5j h SER 1091N 0.08 0.83 0.40 -2.24 0.87 -1.24 0.94 113.55 113.18 2o5j h SER 1091Ca 0.00 -0.65 -0.12 0.00 -1.23 0.00 0.00 61.79 59.79 2o5j h SER 1091Cb 0.50 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 2o5j h SER 1091CO 0.00 1.45 -0.52 1.23 -0.53 0.00 0.00 176.83 178.46 2o5j h GLY 1092N 0.62 0.16 0.69 5.77 0.00 -1.56 -1.02 103.07 107.73 2o5j h GLY 1092Ca -0.11 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.04 2o5j h GLY 1092CO 0.19 0.16 -0.02 -1.82 0.00 0.00 0.00 176.54 175.05 2o5j h TYR 1093N 0.11 -0.05 -0.99 5.60 5.03 -1.22 0.34 116.97 125.79 2o5j h TYR 1093Ca 0.00 -0.00 0.08 0.00 2.58 0.00 0.00 58.73 61.39 2o5j h TYR 1093Cb 0.96 0.02 -0.07 0.00 1.55 0.00 0.00 36.73 39.19 2o5j h TYR 1093CO 0.01 0.26 0.63 1.25 -1.32 0.00 0.00 178.16 179.00 2o5j h LEU 1094N -0.36 0.99 -0.35 2.82 5.85 -0.72 -1.23 115.31 122.31 2o5j h LEU 1094Ca -0.01 0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.55 2o5j h LEU 1094Cb 0.33 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 2o5j h LEU 1094CO 0.01 0.60 -0.67 0.74 -0.34 0.00 0.00 178.44 178.78 2o5j h THR 1095N 1.11 1.32 -0.22 1.05 2.02 -0.90 -2.12 112.91 115.16 2o5j h THR 1095Ca 0.45 -1.95 -0.14 0.00 0.77 0.00 0.00 66.41 65.54 2o5j h THR 1095Cb 0.26 1.92 -0.01 0.00 -1.74 0.00 0.00 68.15 68.58 2o5j h THR 1095CO -0.20 0.61 -0.43 0.03 0.37 0.00 0.00 175.52 175.90 2o5j h ARG 1096N 0.44 0.55 -0.08 6.66 3.08 0.06 -2.44 114.38 122.65 2o5j h ARG 1096Ca -0.02 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.74 2o5j h ARG 1096Cb 1.26 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.32 2o5j h ARG 1096CO 0.13 0.87 0.04 0.87 -1.07 0.00 0.00 179.97 180.81 2o5j h LYS 1097N 0.45 0.12 -0.38 0.04 1.79 -1.11 -1.81 116.57 115.67 2o5j h LYS 1097Ca 0.03 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.47 2o5j h LYS 1097Cb 0.93 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.54 2o5j h LYS 1097CO 0.08 0.19 0.18 -0.07 -1.08 0.00 0.00 179.45 178.75 2o5j h LEU 1098N 0.01 0.51 -0.11 2.94 4.07 -1.36 -3.08 115.31 118.29 2o5j h LEU 1098Ca 0.03 -0.14 -0.01 0.00 0.08 0.00 0.00 57.88 57.84 2o5j h LEU 1098Cb 0.11 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 41.72 2o5j h LEU 1098CO -0.00 0.50 0.02 0.58 -1.08 0.00 0.00 178.44 178.46 2o5j h VAL 1099N 0.48 1.21 0.00 1.22 2.07 -1.42 0.34 116.25 120.14 2o5j h VAL 1099Ca 0.13 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 67.00 2o5j h VAL 1099Cb 0.14 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 2o5j h VAL 1099CO -0.01 0.19 0.11 0.44 0.02 0.00 0.00 177.57 178.32 2o5j h ASP 1100N -0.04 0.00 0.00 0.57 5.19 -1.28 -0.72 116.42 120.14 2o5j h ASP 1100Ca 0.03 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.21 2o5j h ASP 1100Cb 0.27 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.74 2o5j h ASP 1100CO 0.00 0.00 -1.89 0.52 -3.12 0.00 0.00 179.24 174.75 2o5j n VAL 1101N -2.34 0.89 -0.12 -1.35 0.31 -0.99 -4.56 118.33 110.18 2o5j n VAL 1101Ca -0.01 -0.53 0.10 0.00 -0.01 0.00 0.00 64.34 63.89 2o5j n VAL 1101Cb 0.15 -0.70 0.25 0.00 -0.91 0.00 0.00 33.84 32.63 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 -2.53 0.82 0.09 2.52 -1.04 0.07 -4.56 114.28 109.66 2o5j n THR 1102Ca -0.22 -0.91 -0.13 0.00 -2.04 0.00 0.00 64.05 60.75 2o5j n THR 1102Cb 0.91 0.67 -0.12 0.00 -1.82 0.00 0.00 70.33 69.96 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 3.82 0.38 0.00 -1.42 -0.00 -1.39 -3.24 115.15 113.30 2o5j h HIS 1103Ca 0.00 -0.27 -0.03 0.00 -0.00 0.00 0.00 60.37 60.07 2o5j h HIS 1103Cb 0.92 -0.02 -0.00 0.00 -0.00 0.00 0.00 27.41 28.31 2o5j h HIS 1103CO 0.35 1.20 -0.13 1.05 -0.00 0.00 0.00 177.93 180.40 2o5j h GLU 1104N 0.07 0.00 -6.14 5.12 4.11 -1.86 -3.37 114.58 112.52 2o5j h GLU 1104Ca -0.10 0.00 -0.58 0.00 0.07 0.00 0.00 59.36 58.75 2o5j h GLU 1104Cb 1.88 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.12 2o5j h GLU 1104CO 0.18 0.13 1.37 0.42 0.07 0.00 0.00 179.01 181.19 2o5j s ILE 1105N -4.14 3.24 0.02 -1.06 -1.09 -1.22 -4.60 121.20 112.34 2o5j s ILE 1105Ca -0.02 0.24 -0.04 0.00 -2.23 0.00 0.00 60.65 58.60 2o5j s ILE 1105Cb 0.13 -3.30 -0.01 0.00 -1.58 0.00 0.00 42.46 37.70 2o5j s ILE 1105CO 0.59 -0.18 0.07 -0.69 -1.23 0.00 0.00 174.94 173.50 2o5j s VAL 1106N 7.39 0.11 -0.41 2.92 1.01 -1.26 -4.13 120.40 126.03 2o5j s VAL 1106Ca 0.90 -0.87 -0.29 0.00 0.00 0.00 0.00 61.98 61.72 2o5j s VAL 1106Cb -0.29 -0.50 0.01 0.00 0.00 0.00 0.00 36.38 35.61 2o5j s VAL 1106CO 0.34 -0.48 1.36 -0.69 0.00 0.00 0.00 175.10 175.63 2o5j s VAL 1107N -1.72 3.98 -0.28 2.92 1.01 -1.13 -2.13 120.40 123.04 2o5j s VAL 1107Ca -0.13 1.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.86 2o5j s VAL 1107Cb -0.07 -4.26 0.13 0.00 0.00 0.00 0.00 36.38 32.18 2o5j s VAL 1107CO -0.01 -0.76 0.27 -0.13 0.00 0.00 0.00 175.10 174.47 2o5j s ARG 1108N 4.76 0.30 0.04 2.72 0.52 -1.21 0.92 118.95 127.01 2o5j s ARG 1108Ca 0.59 -0.17 -0.02 0.00 -0.52 0.00 0.00 55.73 55.61 2o5j s ARG 1108Cb -0.13 -0.75 0.01 0.00 0.52 0.00 0.00 34.95 34.60 2o5j s ARG 1108CO 0.31 -1.01 0.11 -0.85 0.02 0.00 0.00 175.30 173.89 2o5j n GLU 1109N 5.30 0.12 -3.95 3.54 -0.00 -1.26 -4.81 120.64 119.59 2o5j n GLU 1109Ca -0.03 -0.25 -0.10 0.00 -0.00 0.00 0.00 57.16 56.79 2o5j n GLU 1109Cb 0.46 0.32 -0.12 0.00 -0.00 0.00 0.00 31.44 32.10 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 -1.13 0.09 -0.52 -1.84 0.00 -1.26 -4.98 121.76 112.11 2o5j s ALA 1110Ca 0.02 -0.44 -0.36 0.00 0.00 0.00 0.00 51.96 51.18 2o5j s ALA 1110Cb -0.01 0.11 -0.15 0.00 0.00 0.00 0.00 23.12 23.08 2o5j s ALA 1110CO 0.01 -0.12 2.29 -3.47 0.00 0.00 0.00 175.76 174.47 2o5j n ASP 1111N 1.96 1.41 -4.63 0.00 -0.08 -1.26 -4.76 116.55 109.19 2o5j n ASP 1111Ca -0.21 0.36 -0.47 0.00 -1.51 0.00 0.00 54.79 52.96 2o5j n ASP 1111Cb 0.56 -1.12 -0.04 0.00 2.34 0.00 0.00 41.12 42.85 2o5j n ASP 1111CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2o5j n GLY 1113N 5.04 -1.08 3.55 0.00 0.00 -1.26 -4.62 105.19 106.82 2o5j n GLY 1113Ca 0.27 0.10 -0.38 0.00 0.00 0.00 0.00 46.02 46.00 2o5j n GLY 1113CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2o5j s THR 1114N -3.34 3.37 -1.19 2.61 -1.32 -1.26 -4.83 115.64 109.68 2o5j s THR 1114Ca 0.02 0.19 -0.10 0.00 -1.21 0.00 0.00 61.69 60.60 2o5j s THR 1114Cb 0.08 -3.99 0.22 0.00 -1.51 0.00 0.00 72.50 67.29 2o5j s THR 1114CO 0.30 -0.96 1.52 0.41 -2.21 0.00 0.00 174.62 173.68 2o5j n THR 1115N 7.19 4.55 -4.63 5.08 -1.04 -1.26 -4.84 114.28 119.34 2o5j n THR 1115Ca 0.20 -4.99 -0.31 0.00 -2.04 0.00 0.00 64.05 56.92 2o5j n THR 1115Cb 0.52 -2.38 -0.12 0.00 -1.82 0.00 0.00 70.33 66.52 2o5j n THR 1115CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2o5j s ASN 1116N 1.06 3.91 0.17 8.00 0.01 -1.26 -5.10 114.94 121.73 2o5j s ASN 1116Ca 0.37 -0.39 -0.18 0.00 -0.71 0.00 0.00 52.86 51.95 2o5j s ASN 1116Cb 0.01 -0.67 0.04 0.00 0.41 0.00 0.00 41.25 41.04 2o5j s ASN 1116CO 0.01 0.26 0.51 -0.72 -1.51 0.00 0.00 177.10 175.64 2o5j s TYR 1117N -0.94 -0.24 0.01 2.20 -0.85 -1.26 -4.80 117.35 111.48 2o5j s TYR 1117Ca 0.15 -0.07 -0.12 0.00 -0.52 0.00 0.00 57.07 56.51 2o5j s TYR 1117Cb -0.11 0.39 -0.05 0.00 0.38 0.00 0.00 41.96 42.57 2o5j s TYR 1117CO 0.06 -0.84 0.37 0.42 -1.52 0.00 0.00 175.55 174.03 2o5j s ILE 1118N -3.83 5.11 -0.29 -3.49 -1.09 -1.26 -4.98 121.20 111.39 2o5j s ILE 1118Ca 0.06 0.61 -0.10 0.00 -2.23 0.00 0.00 60.65 58.99 2o5j s ILE 1118Cb -0.00 -3.65 -0.03 0.00 -1.58 0.00 0.00 42.46 37.19 2o5j s ILE 1118CO -0.08 0.48 0.16 -0.44 -1.23 0.00 0.00 174.94 173.83 2o5j s SER 1119N -1.33 5.74 -0.41 3.58 0.01 -1.26 -3.32 113.70 116.71 2o5j s SER 1119Ca 0.26 -0.19 -0.27 0.00 1.31 0.00 0.00 55.95 57.05 2o5j s SER 1119Cb -0.15 -2.06 0.02 0.00 0.21 0.00 0.00 66.02 64.04 2o5j s SER 1119CO 0.14 -0.09 1.02 -0.69 0.41 0.00 0.00 173.24 174.03 2o5j s VAL 1120N 1.70 4.42 0.34 3.43 1.01 -1.01 -4.74 120.40 125.56 2o5j s VAL 1120Ca 0.06 1.21 -0.28 0.00 0.00 0.00 0.00 61.98 62.97 2o5j s VAL 1120Cb -0.16 -4.46 -0.10 0.00 0.00 0.00 0.00 36.38 31.67 2o5j s VAL 1120CO 0.08 -0.74 1.23 -2.84 0.00 0.00 0.00 175.10 172.83 2o5j s PRO 1121N 3.88 4.33 -0.01 2.72 0.02 -1.26 -1.62 135.00 143.07 2o5j s PRO 1121Ca 0.42 2.03 0.15 0.00 0.02 0.00 0.00 61.00 63.63 2o5j s PRO 1121Cb -0.10 -2.99 -0.18 0.00 0.02 0.00 0.00 34.50 31.25 2o5j s PRO 1121CO 0.24 -0.14 0.56 1.28 -0.33 0.00 0.00 177.00 178.60 2o5j n LEU 1122N 0.68 0.52 -4.29 -5.54 4.32 -0.39 -4.96 117.00 107.34 2o5j n LEU 1122Ca 0.01 -0.36 -0.23 0.00 -0.02 0.00 0.00 56.01 55.40 2o5j n LEU 1122Cb 0.44 0.00 -0.12 0.00 -1.62 0.00 0.00 43.42 42.11 2o5j n LEU 1122CO 0.56 0.13 -0.51 -0.36 -1.22 0.00 0.00 177.39 175.99 2o5j s PHE 1123N -2.60 1.79 -0.08 -1.77 0.08 -1.26 -0.41 117.98 113.73 2o5j s PHE 1123Ca 0.03 -0.43 0.05 0.00 0.12 0.00 0.00 56.93 56.69 2o5j s PHE 1123Cb 0.11 -0.96 -0.00 0.00 -0.57 0.00 0.00 43.02 41.60 2o5j s PHE 1123CO 0.63 0.23 -0.23 1.14 -0.10 0.00 0.00 175.22 176.89 2o5j s GLN 1124N -2.12 2.69 0.00 0.44 -2.07 -0.86 -4.85 119.66 112.89 2o5j s GLN 1124Ca 0.08 -0.84 0.00 0.00 -1.82 0.00 0.00 55.36 52.79 2o5j s GLN 1124Cb -0.09 -2.14 0.00 0.00 -1.09 0.00 0.00 33.01 29.69 2o5j s GLN 1124CO 0.05 0.24 0.38 -2.30 -1.32 0.00 0.00 175.29 172.35 2o5j n PRO 1125N 3.32 0.00 -3.79 9.60 -0.02 -1.26 -3.26 135.00 139.59 2o5j n PRO 1125Ca -0.19 0.15 -0.35 0.00 -2.02 0.00 0.00 63.50 61.09 2o5j n PRO 1125Cb 0.53 -0.88 -0.11 0.00 -0.02 0.00 0.00 33.50 33.01 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 -2.40 5.14 -0.24 2.55 -1.08 -1.26 -3.56 116.67 115.83 2o5j s ASP 1126Ca 0.00 -2.40 -0.10 0.00 -0.52 0.00 0.00 52.55 49.53 2o5j s ASP 1126Cb 0.00 -1.81 -0.11 0.00 -1.46 0.00 0.00 42.92 39.54 2o5j s ASP 1126CO 0.00 -0.45 -0.30 1.21 0.52 0.00 0.00 175.17 176.16 2o5j n GLU 1127N 4.08 0.52 -4.55 4.34 0.00 -1.26 -4.90 120.64 118.87 2o5j n GLU 1127Ca 0.02 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 3.66 0.00 6.31 1.01 -1.26 -5.07 120.40 122.61 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 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.94 2o5j s VAL 1128CO 0.44 0.53 0.00 1.07 0.00 0.00 0.00 175.10 177.14 2o5j n THR 1129N 3.17 0.00 -3.80 3.92 5.66 -1.26 -3.60 114.28 118.36 2o5j n THR 1129Ca -0.18 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.54 2o5j n THR 1129Cb 0.53 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 69.15 2o5j n THR 1129CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2o5j s ARG 1130N 0.00 0.97 -0.25 1.09 3.00 -1.26 -4.27 118.95 118.23 2o5j s ARG 1130Ca 0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 55.73 55.01 2o5j s ARG 1130Cb 0.00 -2.26 0.13 0.00 0.00 0.00 0.00 34.95 32.82 2o5j s ARG 1130CO 0.00 -0.66 0.48 -1.54 0.00 0.00 0.00 175.30 173.59 2o5j s SER 1131N 1.68 -0.50 0.28 0.23 1.04 -1.23 -5.11 113.70 110.09 2o5j s SER 1131Ca -0.02 0.81 -0.29 0.00 0.48 0.00 0.00 55.95 56.93 2o5j s SER 1131Cb -0.18 1.62 -0.10 0.00 0.10 0.00 0.00 66.02 67.46 2o5j s SER 1131CO -0.09 -0.26 1.31 -0.76 0.98 0.00 0.00 173.24 174.42 2o5j s LEU 1132N 2.69 4.43 0.03 2.42 1.02 -1.26 -4.70 118.68 123.31 2o5j s LEU 1132Ca 0.08 2.57 -0.04 0.00 0.02 0.00 0.00 54.13 56.76 2o5j s LEU 1132Cb -0.14 -3.63 -0.02 0.00 0.02 0.00 0.00 46.19 42.42 2o5j s LEU 1132CO -0.17 -0.52 0.05 0.00 0.02 0.00 0.00 176.35 175.73 2o5j s ARG 1133N -1.06 0.51 -0.12 1.70 1.70 -1.20 -5.00 118.95 115.47 2o5j s ARG 1133Ca 0.52 -0.74 -0.29 0.00 -0.47 0.00 0.00 55.73 54.75 2o5j s ARG 1133Cb -0.38 0.19 -0.02 0.00 -0.57 0.00 0.00 34.95 34.17 2o5j s ARG 1133CO 0.46 -0.11 1.26 -1.17 -1.08 0.00 0.00 175.30 174.66 2o5j s LEU 1134N -1.99 4.22 1.05 -1.89 2.96 -1.26 -2.04 118.68 119.74 2o5j s LEU 1134Ca -0.07 1.76 -0.13 0.00 -0.22 0.00 0.00 54.13 55.47 2o5j s LEU 1134Cb -0.03 -3.55 0.15 0.00 0.50 0.00 0.00 46.19 43.27 2o5j s LEU 1134CO -0.04 -0.71 0.66 0.54 -1.32 0.00 0.00 176.35 175.48 2o5j n ARG 1135N 6.12 -1.28 -1.44 1.98 5.12 0.45 -4.88 116.66 122.73 2o5j n ARG 1135Ca 0.13 -0.33 -0.34 0.00 -1.93 0.00 0.00 57.85 55.37 2o5j n ARG 1135Cb 0.45 -2.03 0.09 0.00 -1.16 0.00 0.00 32.46 29.81 2o5j n ARG 1135CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2o5j s LYS 1136N -4.04 2.16 0.00 5.56 1.02 -1.26 -4.91 119.74 118.26 2o5j s LYS 1136Ca 0.62 1.75 0.00 0.00 0.02 0.00 0.00 55.97 58.37 2o5j s LYS 1136Cb -0.21 -1.84 0.00 0.00 -0.52 0.00 0.00 37.83 35.27 2o5j s LYS 1136CO 0.64 -1.82 0.69 -2.13 -0.92 0.00 0.00 175.35 171.81 2o5j n ARG 1137N -2.71 0.00 -0.34 1.68 0.63 -1.26 -2.63 116.66 112.02 2o5j n ARG 1137Ca 0.13 0.35 0.13 0.00 -0.92 0.00 0.00 57.85 57.54 2o5j n ARG 1137Cb 0.50 -1.25 0.27 0.00 0.45 0.00 0.00 32.46 32.43 2o5j n ARG 1137CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2o5j h ALA 1138N -2.00 1.11 0.41 5.13 0.00 -2.00 -0.88 119.26 121.03 2o5j h ALA 1138Ca 0.00 0.35 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 2o5j h ALA 1138Cb 0.00 0.61 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 2o5j h ALA 1138CO 0.00 -0.55 -0.45 -0.44 0.00 0.00 0.00 179.25 177.82 2o5j h ASP 1139N 0.01 -1.23 -0.59 0.00 3.32 -1.96 -0.20 116.42 115.78 2o5j h ASP 1139Ca 0.58 0.10 0.12 0.00 0.02 0.00 0.00 57.03 57.86 2o5j h ASP 1139Cb 1.17 0.41 -0.11 0.00 0.22 0.00 0.00 39.33 41.02 2o5j h ASP 1139CO -0.93 -0.59 -0.16 0.40 -1.72 0.00 0.00 179.24 176.24 2o5j h ILE 1140N -0.88 0.40 -0.66 0.35 2.04 -0.93 0.32 117.51 118.14 2o5j h ILE 1140Ca -0.04 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.96 2o5j h ILE 1140Cb 0.79 0.40 -0.10 0.00 -0.74 0.00 0.00 36.82 37.16 2o5j h ILE 1140CO -0.08 0.00 0.09 -0.33 0.00 0.00 0.00 178.15 177.82 2o5j h GLU 1141N -0.01 0.19 -1.00 2.37 5.08 -0.95 0.46 114.58 120.72 2o5j h GLU 1141Ca 0.28 -0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.73 2o5j h GLU 1141Cb 0.44 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.57 2o5j h GLU 1141CO -0.61 0.13 0.63 0.00 -1.00 0.00 0.00 179.01 178.15 2o5j h ALA 1142N 1.57 1.47 -0.08 3.43 0.00 0.14 0.31 119.26 126.09 2o5j h ALA 1142Ca 0.36 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.25 2o5j h ALA 1142Cb 0.59 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2o5j h ALA 1142CO -0.50 0.28 -0.07 0.78 0.00 0.00 0.00 179.25 179.73 2o5j h GLY 1143N 1.04 0.21 -0.67 0.00 0.00 0.17 -3.17 103.07 100.65 2o5j h GLY 1143Ca 0.48 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.60 2o5j h GLY 1143CO -0.24 0.19 -0.38 1.04 0.00 0.00 0.00 176.54 177.15 2o5j n LEU 1144N -4.70 1.56 -4.66 3.11 4.77 -0.55 -4.84 117.00 111.68 2o5j n LEU 1144Ca -0.07 -0.74 -0.44 0.00 -0.03 0.00 0.00 56.01 54.73 2o5j n LEU 1144Cb 0.30 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.37 2o5j n LEU 1144CO 0.36 0.30 0.89 0.00 -1.33 0.00 0.00 177.39 177.61 2o5j n TYR 1145N -0.24 2.03 -4.13 -1.77 4.19 0.11 -2.19 117.16 115.15 2o5j n TYR 1145Ca 0.06 0.53 -0.32 0.00 3.31 0.00 0.00 57.90 61.49 2o5j n TYR 1145Cb 0.34 -2.40 -0.08 0.00 0.49 0.00 0.00 39.34 37.69 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 1.46 -0.21 2.65 2.98 0.00 0.29 -4.76 105.19 107.60 2o5j n GLY 1146Ca 0.09 0.11 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 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 -3.91 0.77 -3.99 1.61 5.12 -0.93 0.20 116.66 115.53 2o5j n ARG 1147Ca -0.11 -2.18 -0.30 0.00 -1.93 0.00 0.00 57.85 53.33 2o5j n ARG 1147Cb 0.51 -0.08 -0.16 0.00 -1.16 0.00 0.00 32.46 31.57 2o5j n ARG 1147CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2o5j s VAL 1148N -1.54 1.60 0.12 1.55 1.01 -1.26 -1.83 120.40 120.06 2o5j s VAL 1148Ca 0.37 -0.92 -0.35 0.00 0.00 0.00 0.00 61.98 61.09 2o5j s VAL 1148Cb -0.03 -1.65 -0.15 0.00 0.00 0.00 0.00 36.38 34.55 2o5j s VAL 1148CO 0.24 0.22 1.51 0.18 0.00 0.00 0.00 175.10 177.25 2o5j n LEU 1149N 4.71 2.57 0.09 3.92 4.77 -1.15 -0.19 117.00 131.73 2o5j n LEU 1149Ca -0.15 1.09 -0.08 0.00 -0.03 0.00 0.00 56.01 56.84 2o5j n LEU 1149Cb 0.47 -1.33 -0.04 0.00 -2.33 0.00 0.00 43.42 40.19 2o5j n LEU 1149CO 0.20 -0.55 0.20 0.00 -1.33 0.00 0.00 177.39 175.91 2o5j h ALA 1150N 5.58 0.46 -2.30 -1.18 0.00 -1.58 0.10 119.26 120.34 2o5j h ALA 1150Ca -0.46 -0.78 -0.12 0.00 0.00 0.00 0.00 54.91 53.55 2o5j h ALA 1150Cb 1.28 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.84 2o5j h ALA 1150CO 0.85 1.00 -0.64 -0.98 0.00 0.00 0.00 179.25 179.49 2o5j s ARG 1151N -3.04 0.68 0.23 0.00 3.03 -1.26 -4.71 118.95 113.88 2o5j s ARG 1151Ca -0.02 -1.22 -0.30 0.00 2.03 0.00 0.00 55.73 56.23 2o5j s ARG 1151Cb 0.10 0.23 -0.09 0.00 -1.03 0.00 0.00 34.95 34.16 2o5j s ARG 1151CO 0.83 -0.15 1.12 -2.00 -1.13 0.00 0.00 175.30 173.96 2o5j s GLU 1152N -3.93 4.60 -0.14 3.89 2.12 -1.26 -4.62 118.70 119.36 2o5j s GLU 1152Ca 0.09 1.79 -0.01 0.00 0.36 0.00 0.00 54.97 57.20 2o5j s GLU 1152Cb 0.08 -3.23 0.04 0.00 0.26 0.00 0.00 34.13 31.27 2o5j s GLU 1152CO -0.09 0.12 -0.05 0.08 -0.54 0.00 0.00 175.26 174.79 2o5j s VAL 1153N -0.66 0.94 -0.32 3.70 1.01 -0.65 -4.98 120.40 119.45 2o5j s VAL 1153Ca 0.47 -0.42 -0.16 0.00 0.00 0.00 0.00 61.98 61.87 2o5j s VAL 1153Cb -0.31 -1.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 2o5j s VAL 1153CO 0.38 0.19 0.44 -1.61 0.00 0.00 0.00 175.10 174.50 2o5j s GLU 1154N 1.72 3.76 0.00 2.72 2.02 -1.26 -1.74 118.70 125.92 2o5j s GLU 1154Ca 0.02 -0.13 0.00 0.00 0.02 0.00 0.00 54.97 54.89 2o5j s GLU 1154Cb -0.14 -3.75 0.00 0.00 0.10 0.00 0.00 34.13 30.34 2o5j s GLU 1154CO -0.08 -0.48 0.00 1.33 0.02 0.00 0.00 175.26 176.05 2o5j n VAL 1155N 5.27 0.00 0.92 2.63 0.24 -1.14 -4.92 118.33 121.34 2o5j n VAL 1155Ca -0.07 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.36 2o5j n VAL 1155Cb 0.50 -0.09 0.38 0.00 -1.47 0.00 0.00 33.84 33.15 2o5j n VAL 1155CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2o5j n LEU 1156N 0.00 0.37 0.00 1.34 4.77 -1.26 -4.80 117.00 117.42 2o5j n LEU 1156Ca 0.00 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 2o5j n LEU 1156Cb 0.00 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 2o5j n LEU 1156CO 0.00 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 2o5j n GLY 1157N 1.47 0.20 3.93 -0.72 0.00 -1.26 -5.13 105.19 103.67 2o5j n GLY 1157Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 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 5.19 -0.63 1.61 1.01 -1.26 -5.07 120.40 121.25 2o5j s VAL 1158Ca 0.00 -0.39 -0.10 0.00 0.00 0.00 0.00 61.98 61.49 2o5j s VAL 1158Cb 0.00 -3.76 0.16 0.00 0.00 0.00 0.00 36.38 32.79 2o5j s VAL 1158CO 0.00 -0.24 0.51 -0.60 0.00 0.00 0.00 175.10 174.78 2o5j s ARG 1159N -3.50 2.89 -0.33 2.72 3.52 -1.26 -2.86 118.95 120.14 2o5j s ARG 1159Ca 0.39 -2.17 -0.29 0.00 -0.13 0.00 0.00 55.73 53.53 2o5j s ARG 1159Cb -0.11 -4.07 -0.01 0.00 -1.56 0.00 0.00 34.95 29.20 2o5j s ARG 1159CO 0.30 -1.23 1.63 -0.51 -0.81 0.00 0.00 175.30 174.68 2o5j s LEU 1160N 0.66 3.63 0.78 -0.88 1.43 -0.71 -4.97 118.68 118.62 2o5j s LEU 1160Ca 0.12 1.24 -0.11 0.00 -1.03 0.00 0.00 54.13 54.35 2o5j s LEU 1160Cb -0.20 -3.53 0.06 0.00 0.03 0.00 0.00 46.19 42.55 2o5j s LEU 1160CO -0.04 -1.51 1.08 -1.83 0.23 0.00 0.00 176.35 174.29 2o5j s GLU 1161N 5.18 2.23 0.73 1.70 1.03 -1.26 -1.63 118.70 126.67 2o5j s GLU 1161Ca 0.72 0.86 -0.13 0.00 0.03 0.00 0.00 54.97 56.45 2o5j s GLU 1161Cb -0.20 -1.92 0.04 0.00 -0.80 0.00 0.00 34.13 31.25 2o5j s GLU 1161CO 0.32 -1.57 1.11 -2.00 -1.33 0.00 0.00 175.26 171.79 2o5j s GLU 1162N -5.04 2.41 0.00 -4.83 -6.30 -1.26 -3.15 118.70 100.53 2o5j s GLU 1162Ca 0.60 1.32 0.00 0.00 -2.50 0.00 0.00 54.97 54.39 2o5j s GLU 1162Cb -0.15 -1.91 0.00 0.00 0.00 0.00 0.00 34.13 32.07 2o5j s GLU 1162CO 0.55 -1.54 0.00 0.41 0.02 0.00 0.00 175.26 174.70 2o5j n GLY 1163N -0.75 0.50 3.73 -1.50 0.00 0.02 -4.92 105.19 102.26 2o5j n GLY 1163Ca 0.10 0.00 -0.42 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 -0.09 4.36 -0.32 1.61 3.52 -1.19 -4.61 118.95 122.23 2o5j s ARG 1164Ca 0.00 2.08 -0.29 0.00 -0.13 0.00 0.00 55.73 57.39 2o5j s ARG 1164Cb 0.00 -3.21 0.01 0.00 -1.56 0.00 0.00 34.95 30.19 2o5j s ARG 1164CO 0.00 -0.33 1.20 0.71 -0.81 0.00 0.00 175.30 176.07 2o5j s TYR 1165N 0.46 2.88 -0.38 5.12 1.51 -1.26 -2.92 117.35 122.76 2o5j s TYR 1165Ca 0.60 0.99 -0.29 0.00 -1.01 0.00 0.00 57.07 57.36 2o5j s TYR 1165Cb -0.37 -3.86 0.02 0.00 -0.11 0.00 0.00 41.96 37.65 2o5j s TYR 1165CO 0.36 -1.31 1.13 -0.48 -1.11 0.00 0.00 175.55 174.14 2o5j s LEU 1166N 4.08 3.80 0.86 -1.29 2.34 -0.76 -4.90 118.68 122.81 2o5j s LEU 1166Ca 0.51 0.82 -0.11 0.00 0.06 0.00 0.00 54.13 55.41 2o5j s LEU 1166Cb -0.14 -3.55 0.11 0.00 -0.56 0.00 0.00 46.19 42.05 2o5j s LEU 1166CO 0.21 -1.07 1.09 -0.55 -1.06 0.00 0.00 176.35 174.97 2o5j s SER 1167N 2.16 3.78 0.60 1.48 0.15 -1.26 -0.55 113.70 120.06 2o5j s SER 1167Ca 0.48 1.48 0.31 0.00 0.70 0.00 0.00 55.95 58.92 2o5j s SER 1167Cb -0.11 -2.17 1.88 0.00 -1.71 0.00 0.00 66.02 63.91 2o5j s SER 1167CO 0.23 -2.44 2.27 -0.03 1.20 0.00 0.00 173.24 174.47 2o5j h MET 1168N -1.41 0.00 -0.11 5.44 4.05 -1.95 0.19 114.93 121.13 2o5j h MET 1168Ca -0.48 0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 58.83 2o5j h MET 1168Cb 1.28 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.06 2o5j h MET 1168CO 0.55 0.00 -0.39 -0.44 0.23 0.00 0.00 176.91 176.87 2o5j h ASP 1169N 0.00 0.24 -0.10 1.39 3.32 -1.99 -1.99 116.42 117.29 2o5j h ASP 1169Ca -0.00 -0.10 -0.16 0.00 0.02 0.00 0.00 57.03 56.79 2o5j h ASP 1169Cb 0.00 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.50 2o5j h ASP 1169CO 0.00 0.61 -0.56 0.44 -1.72 0.00 0.00 179.24 178.01 2o5j h ASP 1170N 0.20 0.66 0.61 6.45 3.32 -0.99 -2.71 116.42 123.96 2o5j h ASP 1170Ca 0.02 -0.65 0.00 0.00 0.02 0.00 0.00 57.03 56.42 2o5j h ASP 1170Cb 0.78 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.13 2o5j h ASP 1170CO 0.06 1.21 0.00 0.52 -1.72 0.00 0.00 179.24 179.31 2o5j n VAL 1171N -4.18 0.92 0.06 -1.35 0.31 -0.70 -1.25 118.33 112.14 2o5j n VAL 1171Ca -0.08 0.25 -0.12 0.00 -0.01 0.00 0.00 64.34 64.38 2o5j n VAL 1171Cb 0.63 -1.11 -0.13 0.00 -0.91 0.00 0.00 33.84 32.32 2o5j n VAL 1171CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 2o5j h HIS 1172N 0.00 0.24 -0.05 3.52 3.86 -1.23 -3.07 115.15 118.40 2o5j h HIS 1172Ca 0.00 -0.17 -0.01 0.00 -1.16 0.00 0.00 60.37 59.02 2o5j h HIS 1172Cb 0.30 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 28.76 2o5j h HIS 1172CO 0.00 1.17 -0.02 1.25 0.86 0.00 0.00 177.93 181.19 2o5j h LEU 1173N 0.04 0.11 -1.43 2.43 5.85 -0.85 -2.27 115.31 119.19 2o5j h LEU 1173Ca -0.14 -0.39 -0.04 0.00 0.84 0.00 0.00 57.88 58.15 2o5j h LEU 1173Cb 1.92 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.90 2o5j h LEU 1173CO 0.15 0.48 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.58 2o5j h LEU 1174N -0.26 0.26 -0.32 2.25 3.38 -1.44 -0.85 115.31 118.33 2o5j h LEU 1174Ca 0.01 -0.05 -0.18 0.00 0.09 0.00 0.00 57.88 57.75 2o5j h LEU 1174Cb 0.43 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2o5j h LEU 1174CO 0.01 0.38 -0.53 0.40 0.09 0.00 0.00 178.44 178.78 2o5j h ILE 1175N 0.27 1.27 0.00 1.22 2.04 -1.47 -1.31 117.51 119.53 2o5j h ILE 1175Ca 0.06 -1.72 -0.04 0.00 1.00 0.00 0.00 64.86 64.17 2o5j h ILE 1175Cb 0.31 1.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 2o5j h ILE 1175CO 0.01 0.56 -0.17 0.11 0.00 0.00 0.00 178.15 178.67 2o5j h LYS 1176N 0.67 0.00 -0.00 2.37 1.57 -0.76 -0.74 116.57 119.68 2o5j h LYS 1176Ca 0.02 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.65 2o5j h LYS 1176Cb 1.14 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.46 2o5j h LYS 1176CO 0.12 0.17 -0.56 0.00 -0.57 0.00 0.00 179.45 178.61 2o5j h ALA 1177N 1.83 0.07 -0.27 3.86 0.00 -0.96 -2.80 119.26 121.00 2o5j h ALA 1177Ca -0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.34 2o5j h ALA 1177Cb 0.34 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2o5j h ALA 1177CO 0.02 0.33 0.10 0.00 0.00 0.00 0.00 179.25 179.70 2o5j h ALA 1178N 0.32 1.68 -0.68 0.00 0.00 -0.90 0.71 119.26 120.39 2o5j h ALA 1178Ca -0.07 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.78 2o5j h ALA 1178Cb 1.28 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 2o5j h ALA 1178CO 0.11 0.26 0.44 0.93 0.00 0.00 0.00 179.25 180.99 2o5j h GLU 1179N 0.37 0.86 -0.35 0.00 4.39 -1.12 -1.77 114.58 116.96 2o5j h GLU 1179Ca 0.09 -0.05 -0.13 0.00 0.34 0.00 0.00 59.36 59.62 2o5j h GLU 1179Cb 0.09 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 2o5j h GLU 1179CO -0.01 0.57 -0.29 0.00 -1.16 0.00 0.00 179.01 178.12 2o5j h ALA 1180N 1.27 0.82 0.00 3.43 0.00 -0.63 -3.48 119.26 120.67 2o5j h ALA 1180Ca 0.26 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2o5j h ALA 1180Cb -0.05 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2o5j h ALA 1180CO -0.08 0.64 0.00 0.41 0.00 0.00 0.00 179.25 180.23 2o5j n GLY 1181N -0.12 0.80 0.00 0.00 0.00 0.23 -5.07 105.19 101.02 2o5j n GLY 1181Ca -0.01 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2o5j n GLY 1181CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2o5j n GLU 1182N 0.00 0.47 -3.77 1.61 4.07 -1.05 -4.99 120.64 116.99 2o5j n GLU 1182Ca 0.00 0.00 -0.14 0.00 -0.06 0.00 0.00 57.16 56.96 2o5j n GLU 1182Cb 0.00 -0.97 -0.15 0.00 -0.06 0.00 0.00 31.44 30.26 2o5j n GLU 1182CO 0.00 0.00 0.00 0.96 -0.06 0.00 0.00 177.13 178.03 2o5j s ILE 1183N -1.89 -0.05 -0.03 6.31 -4.36 -1.26 -5.02 121.20 114.91 2o5j s ILE 1183Ca 0.00 0.17 0.20 0.00 -0.26 0.00 0.00 60.65 60.76 2o5j s ILE 1183Cb 0.00 -0.17 -0.31 0.00 1.25 0.00 0.00 42.46 43.23 2o5j s ILE 1183CO 0.00 0.07 0.42 0.00 0.24 0.00 0.00 174.94 175.67 2o5j n GLN 1184N 4.05 0.62 -3.91 0.37 3.00 -1.26 -4.58 117.38 115.67 2o5j n GLN 1184Ca -0.25 -0.17 -0.16 0.00 -0.01 0.00 0.00 57.00 56.41 2o5j n GLN 1184Cb 0.52 -1.47 -0.05 0.00 0.00 0.00 0.00 30.24 29.24 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 -2.22 0.52 -3.70 -1.09 1.02 -1.26 -1.26 120.64 112.66 2o5j n GLU 1185Ca -0.05 -2.81 -0.17 0.00 -0.02 0.00 0.00 57.16 54.12 2o5j n GLU 1185Cb 0.55 2.50 -0.16 0.00 -0.02 0.00 0.00 31.44 34.31 2o5j n GLU 1185CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2o5j s VAL 1186N -3.00 -0.14 -0.24 2.62 1.01 -0.64 -4.85 120.40 115.17 2o5j s VAL 1186Ca 0.31 0.33 -0.29 0.00 0.00 0.00 0.00 61.98 62.33 2o5j s VAL 1186Cb 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 36.38 36.19 2o5j s VAL 1186CO 0.22 0.14 1.23 -2.16 0.00 0.00 0.00 175.10 174.53 2o5j s PRO 1187N 1.85 4.10 -0.13 2.72 0.04 -1.26 -2.39 135.00 139.92 2o5j s PRO 1187Ca -0.00 1.41 -0.11 0.00 0.04 0.00 0.00 61.00 62.34 2o5j s PRO 1187Cb -0.12 -3.79 0.04 0.00 0.04 0.00 0.00 34.50 30.66 2o5j s PRO 1187CO -0.04 -0.88 0.33 0.54 0.04 0.00 0.00 177.00 176.99 2o5j s VAL 1188N 3.82 -0.01 -0.12 -0.36 0.11 -1.21 -1.60 120.40 121.04 2o5j s VAL 1188Ca 0.53 0.03 -0.34 0.00 -2.93 0.00 0.00 61.98 59.27 2o5j s VAL 1188Cb -0.18 -0.48 -0.11 0.00 -1.53 0.00 0.00 36.38 34.08 2o5j s VAL 1188CO 0.17 0.01 1.92 0.54 -3.33 0.00 0.00 175.10 174.41 2o5j n ARG 1189N 3.20 2.07 -4.27 1.54 5.12 0.74 -4.02 116.66 121.03 2o5j n ARG 1189Ca -0.15 0.74 -0.18 0.00 -1.93 0.00 0.00 57.85 56.32 2o5j n ARG 1189Cb 0.57 -2.65 -0.13 0.00 -1.16 0.00 0.00 32.46 29.09 2o5j n ARG 1189CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2o5j s SER 1190N 4.49 1.48 0.58 0.55 0.15 -1.24 -4.47 113.70 115.23 2o5j s SER 1190Ca 0.95 -0.47 0.29 0.00 0.70 0.00 0.00 55.95 57.42 2o5j s SER 1190Cb -0.70 -0.07 1.47 0.00 -1.71 0.00 0.00 66.02 65.00 2o5j s SER 1190CO 0.51 -0.01 1.89 -0.65 1.20 0.00 0.00 173.24 176.18 2o5j h PRO 1191N 4.85 0.00 0.00 5.44 0.11 -1.91 0.94 132.00 141.43 2o5j h PRO 1191Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2o5j h PRO 1191Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2o5j h PRO 1191CO 0.43 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.50 2o5j n LEU 1192N -3.81 0.38 -1.81 2.35 4.77 -1.26 -2.53 117.00 115.09 2o5j n LEU 1192Ca 0.10 0.64 0.01 0.00 -0.03 0.00 0.00 56.01 56.74 2o5j n LEU 1192Cb 0.72 -0.65 0.05 0.00 -2.33 0.00 0.00 43.42 41.21 2o5j n LEU 1192CO 0.29 -0.67 0.08 0.35 -1.33 0.00 0.00 177.39 176.12 2o5j n THR 1193N -1.97 0.81 -1.88 -5.08 -2.24 0.32 -4.99 114.28 99.24 2o5j n THR 1193Ca 0.00 -2.04 -0.31 0.00 -2.27 0.00 0.00 64.05 59.43 2o5j n THR 1193Cb 0.09 0.79 0.01 0.00 -2.10 0.00 0.00 70.33 69.12 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 -2.62 0.66 -1.54 0.00 10.64 -1.26 -4.88 117.38 118.39 2o5j n GLN 1195Ca 0.07 0.11 -0.33 0.00 -1.83 0.00 0.00 57.00 55.01 2o5j n GLN 1195Cb 0.54 -1.52 -0.07 0.00 -0.86 0.00 0.00 30.24 28.32 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 -3.12 -0.05 -0.08 -0.39 -1.04 -1.26 -4.83 114.28 103.51 2o5j n THR 1196Ca -0.42 -0.58 -0.02 0.00 -2.04 0.00 0.00 64.05 60.99 2o5j n THR 1196Cb 1.04 -2.06 -0.02 0.00 -1.82 0.00 0.00 70.33 67.47 2o5j n THR 1196CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2o5j n ARG 1197N 8.70 -0.08 -3.62 -2.82 3.00 -1.26 -3.17 116.66 117.41 2o5j n ARG 1197Ca 0.46 0.90 -0.39 0.00 -0.01 0.00 0.00 57.85 58.81 2o5j n ARG 1197Cb 0.40 -1.35 -0.09 0.00 0.00 0.00 0.00 32.46 31.42 2o5j n ARG 1197CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 2o5j s TYR 1198N -3.56 3.47 0.00 -1.55 4.12 -1.26 -4.98 117.35 113.59 2o5j s TYR 1198Ca -0.02 -2.01 0.00 0.00 0.02 0.00 0.00 57.07 55.06 2o5j s TYR 1198Cb 0.02 -3.38 0.00 0.00 -1.52 0.00 0.00 41.96 37.08 2o5j s TYR 1198CO 0.12 -0.98 0.00 0.41 0.02 0.00 0.00 175.55 175.12 2o5j n GLY 1199N 4.82 3.55 3.16 0.71 0.00 -1.19 -4.82 105.19 111.42 2o5j n GLY 1199Ca -0.06 -1.81 -0.24 0.00 0.00 0.00 0.00 46.02 43.90 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 -2.44 1.32 0.71 1.61 1.01 -0.91 -4.38 120.40 117.33 2o5j s VAL 1200Ca 0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.12 2o5j s VAL 1200Cb 0.00 -1.12 0.09 0.00 0.00 0.00 0.00 36.38 35.35 2o5j s VAL 1200CO 0.00 0.29 1.00 0.00 0.00 0.00 0.00 175.10 176.40 2o5j h GLN 1202N -0.58 0.98 0.00 0.00 4.15 -1.89 -1.61 115.11 116.15 2o5j h GLN 1202Ca -0.42 -0.33 -0.15 0.00 0.77 0.00 0.00 58.65 58.52 2o5j h GLN 1202Cb 1.29 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.88 2o5j h GLN 1202CO 0.51 1.00 -0.71 0.87 -1.93 0.00 0.00 178.83 178.57 2o5j h LYS 1203N 0.85 0.00 -0.03 1.69 1.79 -1.92 -3.00 116.57 115.94 2o5j h LYS 1203Ca 0.15 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.47 2o5j h LYS 1203Cb 0.59 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.25 2o5j h LYS 1203CO 0.04 0.71 -0.55 0.00 -1.08 0.00 0.00 179.45 178.57 2o5j n TYR 1205N -4.24 0.00 0.00 0.00 9.36 -0.62 -3.72 117.16 117.94 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 0.64 -0.29 0.00 0.00 -0.63 0.00 0.00 39.34 39.06 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 0.54 0.12 0.00 2.98 0.00 -1.13 -4.68 105.19 103.02 2o5j n GLY 1206Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 0.53 -0.53 117.16 117.23 2o5j n TYR 1207Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 57.90 57.73 2o5j n TYR 1207Cb 0.00 -0.06 -0.12 0.00 -0.00 0.00 0.00 39.34 39.16 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 -2.33 0.71 -3.48 2.98 2.03 -1.26 -2.09 116.55 113.12 2o5j n ASP 1208Ca 0.00 -1.14 -0.14 0.00 0.52 0.00 0.00 54.79 54.04 2o5j n ASP 1208Cb 0.00 -1.28 0.07 0.00 -0.72 0.00 0.00 41.12 39.20 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 14.20 0.00 0.10 -2.67 0.00 -1.26 -4.91 117.00 122.46 2o5j n LEU 1209Ca 0.54 -1.22 0.19 0.00 0.00 0.00 0.00 56.01 55.52 2o5j n LEU 1209Cb 0.33 -0.39 0.75 0.00 0.00 0.00 0.00 43.42 44.11 2o5j n LEU 1209CO 0.74 -0.80 1.17 -1.28 0.00 0.00 0.00 177.39 177.21 2o5j h SER 1210N -0.39 0.00 -4.35 1.96 0.87 -1.92 -3.40 113.55 106.31 2o5j h SER 1210Ca -0.20 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 59.85 2o5j h SER 1210Cb 0.72 0.00 0.08 0.00 -0.44 0.00 0.00 62.40 62.76 2o5j h SER 1210CO 0.21 0.00 0.39 -0.32 -0.53 0.00 0.00 176.83 176.58 2o5j s MET 1211N -4.78 3.18 0.00 2.24 0.00 -1.26 -4.34 119.30 114.33 2o5j s MET 1211Ca -0.05 0.81 0.26 0.00 0.00 0.00 0.00 55.69 56.72 2o5j s MET 1211Cb 0.17 -2.03 0.71 0.00 0.00 0.00 0.00 34.83 33.68 2o5j s MET 1211CO 0.62 -0.89 1.54 0.00 0.00 0.00 0.00 175.02 176.29 2o5j n ALA 1212N -2.97 3.21 -1.95 4.11 0.00 -1.26 -4.40 120.51 117.24 2o5j n ALA 1212Ca 0.07 -0.37 -0.24 0.00 0.00 0.00 0.00 53.44 52.90 2o5j n ALA 1212Cb 0.54 -1.15 0.07 0.00 0.00 0.00 0.00 19.45 18.91 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 -2.69 2.14 0.80 0.00 1.04 -1.26 -4.69 118.95 114.28 2o5j s ARG 1213Ca 0.20 -0.57 -0.17 0.00 -1.04 0.00 0.00 55.73 54.14 2o5j s ARG 1213Cb 0.19 -2.28 -0.13 0.00 -2.04 0.00 0.00 34.95 30.68 2o5j s ARG 1213CO 0.58 -1.17 -0.41 -2.30 -0.04 0.00 0.00 175.30 171.96 2o5j n PRO 1214N -2.77 0.01 -2.02 3.89 -0.02 -1.25 -4.24 135.00 128.61 2o5j n PRO 1214Ca 0.10 0.01 -0.41 0.00 -2.02 0.00 0.00 63.50 61.17 2o5j n PRO 1214Cb 0.60 -1.10 -0.02 0.00 -0.02 0.00 0.00 33.50 32.96 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 2.69 -0.06 -1.45 1.01 0.31 -4.75 120.40 116.14 2o5j s VAL 1215Ca 0.49 0.57 -0.24 0.00 0.00 0.00 0.00 61.98 62.80 2o5j s VAL 1215Cb -0.31 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 2o5j s VAL 1215CO 0.74 0.09 0.72 -0.44 0.00 0.00 0.00 175.10 176.21 2o5j s SER 1216N 0.43 7.02 0.28 3.32 0.01 -1.26 -4.87 113.70 118.63 2o5j s SER 1216Ca 0.60 1.23 -0.29 0.00 1.31 0.00 0.00 55.95 58.80 2o5j s SER 1216Cb -0.42 -2.43 -0.14 0.00 0.21 0.00 0.00 66.02 63.25 2o5j s SER 1216CO 0.42 -0.13 1.18 -0.38 0.41 0.00 0.00 173.24 174.74 2o5j n ILE 1217N 3.79 1.69 -0.56 1.44 5.41 -1.26 -2.96 119.36 126.91 2o5j n ILE 1217Ca -0.01 -0.42 0.00 0.00 1.00 0.00 0.00 62.75 63.32 2o5j n ILE 1217Cb 0.51 -1.24 0.00 0.00 -0.71 0.00 0.00 39.64 38.21 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 1.34 1.03 3.88 7.39 0.00 0.26 -4.95 105.19 114.15 2o5j n GLY 1218Ca 0.09 -0.39 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.39 3.48 -1.34 1.61 2.12 -1.15 -2.35 118.70 119.67 2o5j s GLU 1219Ca 0.00 -0.11 -0.13 0.00 0.36 0.00 0.00 54.97 55.09 2o5j s GLU 1219Cb 0.00 -3.18 0.11 0.00 0.26 0.00 0.00 34.13 31.32 2o5j s GLU 1219CO 0.00 0.76 1.94 0.00 -0.54 0.00 0.00 175.26 177.41 2o5j n ALA 1220N 1.81 5.03 -0.89 6.30 0.00 -1.26 -2.82 120.51 128.68 2o5j n ALA 1220Ca -0.18 -4.09 0.00 0.00 0.00 0.00 0.00 53.44 49.17 2o5j n ALA 1220Cb 0.54 -3.27 0.00 0.00 0.00 0.00 0.00 19.45 16.72 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 4.52 0.00 -0.09 0.00 0.31 -1.26 -2.62 118.33 119.18 2o5j n VAL 1221Ca 0.45 1.06 -0.01 0.00 -0.01 0.00 0.00 64.34 65.82 2o5j n VAL 1221Cb 0.39 -2.03 -0.01 0.00 -0.91 0.00 0.00 33.84 31.28 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 -0.58 -0.53 0.34 2.92 0.00 -1.26 0.18 105.19 106.27 2o5j n GLY 1222Ca 0.00 0.26 -0.11 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 -0.96 -0.61 5.03 -1.72 0.32 117.51 119.58 2o5j h ILE 1223Ca 0.06 0.00 0.28 0.00 -0.12 0.00 0.00 64.86 65.08 2o5j h ILE 1223Cb 0.11 0.00 -0.17 0.00 -3.03 0.00 0.00 36.82 33.73 2o5j h ILE 1223CO -0.22 0.00 0.17 0.58 -0.68 0.00 0.00 178.15 178.00 2o5j h VAL 1224N -0.33 0.10 0.36 1.67 2.07 0.21 0.51 116.25 120.85 2o5j h VAL 1224Ca 0.05 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 2o5j h VAL 1224Cb 0.46 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2o5j h VAL 1224CO -0.41 0.01 -0.17 0.00 0.02 0.00 0.00 177.57 177.01 2o5j h ALA 1225N 1.93 -0.48 -0.46 1.67 0.00 -0.03 0.11 119.26 122.00 2o5j h ALA 1225Ca 0.62 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.46 2o5j h ALA 1225Cb 1.35 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 19.28 2o5j h ALA 1225CO -0.82 -0.73 0.16 0.00 0.00 0.00 0.00 179.25 177.86 2o5j h ALA 1226N 0.04 0.55 -0.84 0.00 0.00 0.26 -0.40 119.26 118.88 2o5j h ALA 1226Ca -0.05 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2o5j h ALA 1226Cb 0.43 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2o5j h ALA 1226CO 0.08 -0.23 0.45 1.96 0.00 0.00 0.00 179.25 181.51 2o5j h GLN 1227N 0.33 1.16 -0.07 0.00 4.20 -0.01 -1.04 115.11 119.69 2o5j h GLN 1227Ca 0.22 -0.14 -0.08 0.00 0.06 0.00 0.00 58.65 58.71 2o5j h GLN 1227Cb 0.22 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 2o5j h GLN 1227CO -0.22 0.85 -0.32 0.66 -0.67 0.00 0.00 178.83 179.14 2o5j h SER 1228N 1.17 0.13 1.02 1.46 4.64 0.37 -1.38 113.55 120.95 2o5j h SER 1228Ca 0.29 -0.04 -0.16 0.00 -0.47 0.00 0.00 61.79 61.42 2o5j h SER 1228Cb 0.03 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 2o5j h SER 1228CO -0.05 0.45 -1.05 0.40 -0.87 0.00 0.00 176.83 175.72 2o5j h ILE 1229N 0.12 0.78 0.15 0.95 2.04 -0.56 -3.24 117.51 117.74 2o5j h ILE 1229Ca 0.02 -2.26 -0.01 0.00 1.00 0.00 0.00 64.86 63.61 2o5j h ILE 1229Cb 0.62 2.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.99 2o5j h ILE 1229CO 0.05 0.44 -0.07 1.23 0.00 0.00 0.00 178.15 179.80 2o5j h GLY 1230N 3.55 -0.21 0.27 5.37 0.00 -0.92 -3.00 103.07 108.13 2o5j h GLY 1230Ca -0.09 0.08 0.03 0.00 0.00 0.00 0.00 47.33 47.34 2o5j h GLY 1230CO 0.06 -0.07 -0.36 -2.09 0.00 0.00 0.00 176.54 174.08 2o5j h GLU 1231N -0.70 -0.52 -0.98 4.80 4.81 -1.40 0.01 114.58 120.60 2o5j h GLU 1231Ca -0.02 0.04 0.27 0.00 -0.13 0.00 0.00 59.36 59.52 2o5j h GLU 1231Cb 0.51 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.96 2o5j h GLU 1231CO 0.03 -0.34 0.69 -1.35 -0.73 0.00 0.00 179.01 177.31 2o5j h PRO 1232N -0.53 0.11 -0.08 0.92 0.11 -1.65 0.16 132.00 131.04 2o5j h PRO 1232Ca 0.05 -0.01 -0.24 0.00 0.11 0.00 0.00 66.00 65.91 2o5j h PRO 1232Cb 0.61 -0.02 0.02 0.00 0.11 0.00 0.00 31.00 31.71 2o5j h PRO 1232CO -0.27 0.07 -0.90 0.78 -0.21 0.00 0.00 178.00 177.47 2o5j h GLY 1233N 0.11 0.83 0.63 -0.55 0.00 -0.96 -3.29 103.07 99.83 2o5j h GLY 1233Ca 0.49 -1.30 0.00 0.00 0.00 0.00 0.00 47.33 46.52 2o5j h GLY 1233CO -0.07 1.15 0.00 -1.30 0.00 0.00 0.00 176.54 176.32 2o5j n THR 1234N -3.91 0.01 -0.07 4.70 -2.24 0.38 -3.31 114.28 109.84 2o5j n THR 1234Ca -0.09 -0.05 -0.07 0.00 -2.27 0.00 0.00 64.05 61.57 2o5j n THR 1234Cb 0.81 -0.28 -0.11 0.00 -2.10 0.00 0.00 70.33 68.65 2o5j n THR 1234CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2o5j n GLN 1235N -0.74 1.77 -0.02 -0.78 0.00 -0.21 -4.52 117.38 112.88 2o5j n GLN 1235Ca 0.21 -0.00 -0.08 0.00 -0.00 0.00 0.00 57.00 57.12 2o5j n GLN 1235Cb 0.14 -1.34 -0.14 0.00 0.00 0.00 0.00 30.24 28.90 2o5j n GLN 1235CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2o5j n LEU 1236N -2.51 0.79 0.03 1.69 4.77 -1.24 -3.40 117.00 117.13 2o5j n LEU 1236Ca -0.22 0.38 -0.10 0.00 -0.03 0.00 0.00 56.01 56.03 2o5j n LEU 1236Cb 0.93 0.19 0.04 0.00 -2.33 0.00 0.00 43.42 42.25 2o5j n LEU 1236CO 0.28 0.38 0.41 0.74 -1.33 0.00 0.00 177.39 177.86 2o5j h THR 1237N 0.00 1.34 0.00 -5.08 2.02 -1.81 -3.08 112.91 106.30 2o5j h THR 1237Ca -0.30 -1.96 -0.08 0.00 0.77 0.00 0.00 66.41 64.84 2o5j h THR 1237Cb 2.00 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 70.34 2o5j h THR 1237CO 0.07 0.60 -0.39 0.24 0.37 0.00 0.00 175.52 176.41 2o5j h MET 1238N 0.36 0.00 0.00 6.66 2.86 -1.80 -3.12 114.93 119.90 2o5j h MET 1238Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2o5j h MET 1238Cb 1.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.87 2o5j h MET 1238CO 0.12 0.39 -0.75 -2.13 1.06 0.00 0.00 176.91 175.60 2o5j n ARG 1239N -3.48 0.11 -0.06 1.72 0.63 -1.21 -3.94 116.66 110.44 2o5j n ARG 1239Ca 0.00 0.01 -0.09 0.00 -0.92 0.00 0.00 57.85 56.84 2o5j n ARG 1239Cb 0.54 -1.54 -0.15 0.00 0.45 0.00 0.00 32.46 31.76 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 -1.70 1.50 0.15 5.15 -1.04 -1.17 -3.34 114.28 113.84 2o5j n THR 1240Ca 0.04 -0.83 0.03 0.00 -2.04 0.00 0.00 64.05 61.25 2o5j n THR 1240Cb 0.37 -0.76 0.14 0.00 -1.82 0.00 0.00 70.33 68.27 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 0.00 0.00 -0.00 -1.42 -5.15 -1.74 -3.26 116.94 105.37 2o5j h PHE 1241Ca -0.42 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.18 2o5j h PHE 1241Cb 2.13 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 38.28 2o5j h PHE 1241CO 0.00 0.51 -0.76 0.45 -2.00 0.00 0.00 178.31 176.50 2o5j h HIS 1242N 0.00 0.08 0.00 6.09 3.86 -1.69 -3.42 115.15 120.06 2o5j h HIS 1242Ca -0.01 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2o5j h HIS 1242Cb 1.22 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.68 2o5j h HIS 1242CO 0.00 0.80 0.00 0.25 0.86 0.00 0.00 177.93 179.84 2o5j n THR 1243N -3.67 0.03 -0.60 2.45 -2.24 -1.21 -5.10 114.28 103.95 2o5j n THR 1243Ca -0.01 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 2o5j n THR 1243Cb 0.74 1.60 0.00 0.00 -2.10 0.00 0.00 70.33 70.56 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 -0.02 0.47 0.00 3.38 0.00 -1.24 -4.94 105.19 102.84 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 -0.68 0.00 -0.02 0.00 -1.26 -4.95 105.19 98.27 2o5j n GLY 1245Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -4.55 118.33 114.19 2o5j n VAL 1246Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 2o5j n VAL 1246Cb 0.00 -0.70 0.02 0.00 -0.91 0.00 0.00 33.84 32.24 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 -1.66 0.02 -0.93 3.52 0.00 -1.99 0.41 119.26 118.62 2o5j h ALA 1247Ca 0.00 0.20 0.22 0.00 0.00 0.00 0.00 54.91 55.32 2o5j h ALA 1247Cb 0.00 0.85 -0.07 0.00 0.00 0.00 0.00 17.79 18.57 2o5j h ALA 1247CO 0.00 -0.66 0.61 0.78 0.00 0.00 0.00 179.25 179.98 2o5j h GLY 1248N -0.12 0.92 1.02 0.00 0.00 -1.98 0.72 103.07 103.64 2o5j h GLY 1248Ca 0.26 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 2o5j h GLY 1248CO -0.77 -0.02 0.29 0.00 0.00 0.00 0.00 176.54 176.04 2o5j h ALA 1249N 1.61 0.91 -0.45 3.60 0.00 -1.15 -2.08 119.26 121.71 2o5j h ALA 1249Ca 0.49 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 55.13 2o5j h ALA 1249Cb 1.24 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2o5j h ALA 1249CO -0.20 0.52 -0.12 0.00 0.00 0.00 0.00 179.25 179.46 2o5j h ALA 1250N 1.14 0.62 0.32 0.00 0.00 -0.84 -2.86 119.26 117.64 2o5j h ALA 1250Ca 0.24 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2o5j h ALA 1250Cb 0.19 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2o5j h ALA 1250CO -0.02 0.51 -0.44 -0.44 0.00 0.00 0.00 179.25 178.87 2o5j h ASP 1251N 0.70 -1.23 -0.02 0.00 3.32 -0.96 0.20 116.42 118.44 2o5j h ASP 1251Ca 0.11 0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 2o5j h ASP 1251Cb 0.66 0.43 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 2o5j h ASP 1251CO 0.05 -0.56 0.01 0.16 -1.72 0.00 0.00 179.24 177.17 2o5j h ILE 1252N -0.81 1.13 -0.02 0.35 3.07 -1.44 -1.92 117.51 117.87 2o5j h ILE 1252Ca -0.02 -0.38 -0.10 0.00 1.55 0.00 0.00 64.86 65.90 2o5j h ILE 1252Cb 0.75 1.36 -0.01 0.00 -0.27 0.00 0.00 36.82 38.65 2o5j h ILE 1252CO -0.13 0.10 -0.48 0.74 -1.05 0.00 0.00 178.15 177.33 2o5j h THR 1253N -0.13 1.34 -0.46 0.16 2.02 -1.51 -1.84 112.91 112.49 2o5j h THR 1253Ca 0.01 -1.65 -0.11 0.00 0.77 0.00 0.00 66.41 65.43 2o5j h THR 1253Cb 0.16 1.86 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 2o5j h THR 1253CO -0.00 0.48 -0.16 1.56 0.37 0.00 0.00 175.52 177.77 2o5j h GLN 1254N 0.05 0.88 0.45 6.66 7.50 -0.82 -3.17 115.11 126.66 2o5j h GLN 1254Ca -0.00 -0.33 -0.02 0.00 0.50 0.00 0.00 58.65 58.80 2o5j h GLN 1254Cb 0.86 -0.05 0.00 0.00 0.05 0.00 0.00 27.48 28.34 2o5j h GLN 1254CO 0.06 0.97 -0.21 0.78 -1.50 0.00 0.00 178.83 178.93 2o5j h GLY 1255N 0.95 -0.63 -0.17 3.46 0.00 -1.01 -1.81 103.07 103.86 2o5j h GLY 1255Ca 0.12 0.23 0.08 0.00 0.00 0.00 0.00 47.33 47.76 2o5j h GLY 1255CO 0.05 -0.23 -0.34 1.41 0.00 0.00 0.00 176.54 177.43 2o5j h LEU 1256N -0.87 -1.14 -0.34 3.11 4.07 -1.44 0.65 115.31 119.35 2o5j h LEU 1256Ca -0.06 0.19 0.03 0.00 0.08 0.00 0.00 57.88 58.13 2o5j h LEU 1256Cb 0.57 0.52 -0.03 0.00 1.08 0.00 0.00 40.66 42.80 2o5j h LEU 1256CO 0.10 -0.33 0.14 -0.65 -1.08 0.00 0.00 178.44 176.62 2o5j h PRO 1257N -0.28 0.29 -0.22 1.13 0.11 -1.58 -1.64 132.00 129.82 2o5j h PRO 1257Ca 0.16 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.22 2o5j h PRO 1257Cb 0.55 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.58 2o5j h PRO 1257CO -0.53 0.19 -0.01 -0.09 -0.21 0.00 0.00 178.00 177.35 2o5j h ARG 1258N 0.30 0.32 0.00 1.05 9.65 -0.25 0.11 114.38 125.55 2o5j h ARG 1258Ca 0.15 -0.05 -0.08 0.00 -1.10 0.00 0.00 59.98 58.90 2o5j h ARG 1258Cb 0.10 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 2o5j h ARG 1258CO -0.14 0.35 -0.36 0.28 2.80 0.00 0.00 179.97 182.90 2o5j h VAL 1259N 0.31 0.66 -0.00 0.20 2.07 0.67 0.40 116.25 120.57 2o5j h VAL 1259Ca 0.07 -1.78 -0.17 0.00 0.82 0.00 0.00 66.70 65.65 2o5j h VAL 1259Cb 0.22 2.21 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 2o5j h VAL 1259CO 0.01 0.35 -0.77 0.40 0.02 0.00 0.00 177.57 177.58 2o5j h ILE 1260N 0.00 1.52 0.00 4.57 5.03 -0.31 -2.26 117.51 126.06 2o5j h ILE 1260Ca -0.00 -2.55 -0.09 0.00 -0.12 0.00 0.00 64.86 62.09 2o5j h ILE 1260Cb 1.18 2.38 -0.01 0.00 -3.03 0.00 0.00 36.82 37.34 2o5j h ILE 1260CO 0.05 0.73 -0.44 -0.33 -0.68 0.00 0.00 178.15 177.48 2o5j h GLU 1261N 0.03 0.00 0.00 2.37 5.08 -0.62 -1.88 114.58 119.57 2o5j h GLU 1261Ca -0.01 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.13 2o5j h GLU 1261Cb 1.35 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.57 2o5j h GLU 1261CO 0.10 0.44 -1.20 1.25 -1.00 0.00 0.00 179.01 178.60 2o5j h LEU 1262N 0.00 0.00 0.18 1.33 5.85 -0.82 -3.31 115.31 118.54 2o5j h LEU 1262Ca -0.00 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.41 2o5j h LEU 1262Cb 1.23 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.28 2o5j h LEU 1262CO 0.06 0.86 -1.41 -0.26 -0.34 0.00 0.00 178.44 177.35 2o5j h PHE 1263N 0.00 0.71 -3.39 1.25 -1.00 -1.44 -3.42 116.94 109.65 2o5j h PHE 1263Ca -0.12 -0.52 -0.58 0.00 2.81 0.00 0.00 57.97 59.56 2o5j h PHE 1263Cb 1.76 -0.03 -0.09 0.00 3.61 0.00 0.00 35.95 41.20 2o5j h PHE 1263CO 0.00 1.44 -0.03 -2.00 -1.61 0.00 0.00 178.31 176.11 2o5j s GLU 1264N -2.62 4.29 -0.03 1.51 2.12 -0.71 -3.04 118.70 120.22 2o5j s GLU 1264Ca -0.07 0.54 -0.27 0.00 0.36 0.00 0.00 54.97 55.52 2o5j s GLU 1264Cb 0.06 -3.50 -0.03 0.00 0.26 0.00 0.00 34.13 30.91 2o5j s GLU 1264CO 0.91 -0.02 0.87 0.00 -0.54 0.00 0.00 175.26 176.48 2o5j s ALA 1265N 1.18 3.23 0.14 6.30 0.00 -1.26 -4.50 121.76 126.85 2o5j s ALA 1265Ca 0.28 0.38 -0.25 0.00 0.00 0.00 0.00 51.96 52.37 2o5j s ALA 1265Cb -0.16 -3.19 0.07 0.00 0.00 0.00 0.00 23.12 19.85 2o5j s ALA 1265CO 0.11 -0.18 1.02 0.50 0.00 0.00 0.00 175.76 177.21 2o5j s ARG 1266N 0.92 1.13 -0.54 0.00 3.52 -1.26 -4.85 118.95 117.87 2o5j s ARG 1266Ca 0.46 -0.65 -0.27 0.00 -0.13 0.00 0.00 55.73 55.14 2o5j s ARG 1266Cb -0.20 0.36 -0.02 0.00 -1.56 0.00 0.00 34.95 33.54 2o5j s ARG 1266CO 0.24 -0.52 1.80 0.50 -0.81 0.00 0.00 175.30 176.52 2o5j s ARG 1267N -2.91 2.86 0.96 5.12 3.52 -1.26 -4.27 118.95 122.97 2o5j s ARG 1267Ca 0.15 0.80 -0.13 0.00 -0.13 0.00 0.00 55.73 56.43 2o5j s ARG 1267Cb -0.01 -4.32 0.06 0.00 -1.56 0.00 0.00 34.95 29.13 2o5j s ARG 1267CO 0.02 -2.44 0.51 -0.35 -0.81 0.00 0.00 175.30 172.23 2o5j n PRO 1268N 8.94 -0.41 0.00 5.12 -0.05 -1.26 -4.93 135.00 142.41 2o5j n PRO 1268Ca 0.20 -0.07 0.00 0.00 -0.05 0.00 0.00 63.50 63.58 2o5j n PRO 1268Cb 0.51 -1.93 0.00 0.00 -0.05 0.00 0.00 33.50 32.02 2o5j n PRO 1268CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 175.50 176.62 2o5j n LYS 1269N -2.16 0.00 -2.96 0.54 4.81 -1.26 -3.89 118.16 113.24 2o5j n LYS 1269Ca 0.07 0.55 -0.43 0.00 -0.87 0.00 0.00 58.31 57.64 2o5j n LYS 1269Cb 0.54 -1.19 -0.05 0.00 0.02 0.00 0.00 35.03 34.35 2o5j n LYS 1269CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2o5j s ALA 1270N -3.11 3.26 -1.06 3.14 0.00 -1.26 -5.13 121.76 117.60 2o5j s ALA 1270Ca 0.00 -1.26 -0.17 0.00 0.00 0.00 0.00 51.96 50.54 2o5j s ALA 1270Cb 0.00 -3.55 0.15 0.00 0.00 0.00 0.00 23.12 19.72 2o5j s ALA 1270CO 0.00 -2.12 1.28 0.21 0.00 0.00 0.00 175.76 175.13 2o5j s LYS 1271N 3.40 3.83 0.00 0.00 2.20 -1.25 -4.58 119.74 123.34 2o5j s LYS 1271Ca 0.27 -2.12 0.00 0.00 -0.36 0.00 0.00 55.97 53.76 2o5j s LYS 1271Cb -0.14 -5.00 0.00 0.00 -1.51 0.00 0.00 37.83 31.18 2o5j s LYS 1271CO 0.19 -1.79 0.00 0.00 -0.36 0.00 0.00 175.35 173.39 2o5j n ALA 1329N 6.23 -1.14 -3.64 3.13 0.00 -1.26 -5.11 120.51 118.72 2o5j n ALA 1329Ca 0.30 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.62 2o5j n ALA 1329Cb 0.46 -0.45 -0.13 0.00 0.00 0.00 0.00 19.45 19.33 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 -4.21 -0.04 -0.13 0.00 1.09 -1.26 -5.01 121.20 111.64 2o5j s ILE 1330Ca 0.00 0.14 -0.29 0.00 -1.10 0.00 0.00 60.65 59.39 2o5j s ILE 1330Cb 0.00 -0.33 -0.01 0.00 -1.06 0.00 0.00 42.46 41.06 2o5j s ILE 1330CO 0.00 0.06 1.05 -0.62 -0.10 0.00 0.00 174.94 175.32 2o5j s ASP 1331N 1.08 7.18 0.11 3.58 3.68 -1.26 -4.79 116.67 126.25 2o5j s ASP 1331Ca -0.08 1.54 -0.34 0.00 2.13 0.00 0.00 52.55 55.80 2o5j s ASP 1331Cb -0.09 -2.55 -0.13 0.00 -1.45 0.00 0.00 42.92 38.69 2o5j s ASP 1331CO -0.07 -0.52 1.55 -0.65 0.13 0.00 0.00 175.17 175.61 2o5j h PRO 1332N 7.25 -0.62 -0.64 4.34 0.11 -1.97 -2.01 132.00 138.45 2o5j h PRO 1332Ca -0.29 0.04 0.08 0.00 0.11 0.00 0.00 66.00 65.94 2o5j h PRO 1332Cb 1.13 0.14 -0.10 0.00 0.11 0.00 0.00 31.00 32.28 2o5j h PRO 1332CO 0.89 -0.41 -0.51 0.45 -0.21 0.00 0.00 178.00 178.20 2o5j h HIS 1333N -0.64 -1.56 -0.28 0.65 3.86 -1.93 0.70 115.15 115.95 2o5j h HIS 1333Ca 0.02 0.09 0.03 0.00 -1.16 0.00 0.00 60.37 59.35 2o5j h HIS 1333Cb 0.70 0.77 -0.03 0.00 1.06 0.00 0.00 27.41 29.91 2o5j h HIS 1333CO -0.54 -0.43 0.11 0.37 0.86 0.00 0.00 177.93 178.30 2o5j h GLN 1334N -0.22 0.23 -0.77 2.45 -0.00 -1.97 -2.08 115.11 112.74 2o5j h GLN 1334Ca 0.15 -0.01 0.09 0.00 -0.00 0.00 0.00 58.65 58.88 2o5j h GLN 1334Cb 0.54 -0.05 -0.05 0.00 0.00 0.00 0.00 27.48 27.92 2o5j h GLN 1334CO -0.73 0.15 0.51 1.25 0.00 0.00 0.00 178.83 180.01 2o5j h LEU 1335N 0.24 0.64 -0.18 -2.39 6.46 -0.19 -0.74 115.31 119.15 2o5j h LEU 1335Ca 0.12 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.89 2o5j h LEU 1335Cb 0.08 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 39.88 2o5j h LEU 1335CO -0.12 0.38 0.09 0.25 -0.62 0.00 0.00 178.44 178.43 2o5j h LEU 1336N 0.71 0.24 -0.37 2.25 5.85 0.98 -1.05 115.31 123.92 2o5j h LEU 1336Ca 0.35 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 2o5j h LEU 1336Cb 0.44 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 2o5j h LEU 1336CO -0.13 0.29 0.21 -0.33 -0.34 0.00 0.00 178.44 178.14 2o5j h GLU 1337N 0.17 0.52 0.08 1.25 3.07 -0.89 -1.01 114.58 117.77 2o5j h GLU 1337Ca 0.06 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2o5j h GLU 1337Cb 0.12 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 2o5j h GLU 1337CO -0.01 0.41 -0.04 0.00 -1.40 0.00 0.00 179.01 177.98 2o5j h ALA 1338N 1.07 -0.11 0.00 3.43 0.00 -1.11 -3.40 119.26 119.15 2o5j h ALA 1338Ca 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2o5j h ALA 1338Cb 0.05 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2o5j h ALA 1338CO -0.02 -0.12 -1.37 1.17 0.00 0.00 0.00 179.25 178.91 2o5j n LYS 1339N -4.81 0.50 0.00 0.00 4.81 -0.40 -5.10 118.16 113.16 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 0.19 -1.63 0.00 0.00 0.02 0.00 0.00 35.03 33.60 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 1.28 1.99 0.07 3.14 0.00 -0.38 -4.72 105.19 106.56 2o5j n GLY 1340Ca -0.01 -2.07 -0.09 0.00 0.00 0.00 0.00 46.02 43.85 2o5j n GLY 1340CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2o5j h PRO 1341N 0.00 -0.02 0.00 1.61 0.11 -1.91 -0.71 132.00 131.08 2o5j h PRO 1341Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2o5j h PRO 1341Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2o5j h PRO 1341CO 0.00 0.61 0.39 0.93 -0.21 0.00 0.00 178.00 179.72 2o5j h GLU 1342N -0.98 0.00 0.05 1.05 4.39 -1.97 1.21 114.58 118.33 2o5j h GLU 1342Ca -0.00 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.40 2o5j h GLU 1342Cb 0.63 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.25 2o5j h GLU 1342CO 0.00 0.00 -1.63 0.00 -1.16 0.00 0.00 179.01 176.22 2o5j n ALA 1343N -1.84 0.85 0.30 3.43 0.00 -1.24 -3.62 120.51 118.39 2o5j n ALA 1343Ca -0.02 -0.56 -0.17 0.00 0.00 0.00 0.00 53.44 52.69 2o5j n ALA 1343Cb 0.43 -0.57 -0.09 0.00 0.00 0.00 0.00 19.45 19.23 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 -0.56 0.47 -0.74 0.00 2.07 0.18 0.36 116.25 118.03 2o5j h VAL 1344Ca -0.40 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.20 2o5j h VAL 1344Cb 1.62 0.48 -0.12 0.00 -1.52 0.00 0.00 31.29 31.75 2o5j h VAL 1344CO -0.10 0.00 -0.49 -0.08 0.02 0.00 0.00 177.57 176.92 2o5j h GLU 1345N -0.73 -0.15 0.00 1.57 4.81 0.92 0.51 114.58 121.51 2o5j h GLU 1345Ca -0.07 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 2o5j h GLU 1345Cb 0.56 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 2o5j h GLU 1345CO 0.12 -0.10 -0.16 -0.09 -0.73 0.00 0.00 179.01 178.06 2o5j h ARG 1346N -0.15 0.00 0.15 1.92 9.65 -1.59 -2.47 114.38 121.89 2o5j h ARG 1346Ca 0.18 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 59.06 2o5j h ARG 1346Cb 0.53 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.11 2o5j h ARG 1346CO -0.80 0.16 -0.07 -0.92 2.80 0.00 0.00 179.97 181.14 2o5j h TYR 1347N 0.00 -0.19 -0.13 2.20 3.20 0.41 -3.03 116.97 119.42 2o5j h TYR 1347Ca -0.00 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.90 2o5j h TYR 1347Cb 0.34 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.63 2o5j h TYR 1347CO 0.00 0.25 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.57 2o5j h LEU 1348N -0.77 -0.42 0.14 2.82 4.07 -0.39 0.25 115.31 121.00 2o5j h LEU 1348Ca -0.02 0.08 0.01 0.00 0.08 0.00 0.00 57.88 58.03 2o5j h LEU 1348Cb 0.53 0.21 -0.04 0.00 1.08 0.00 0.00 40.66 42.43 2o5j h LEU 1348CO 0.03 -0.18 -0.49 0.58 -1.08 0.00 0.00 178.44 177.30 2o5j h VAL 1349N -0.16 0.00 -0.62 1.22 2.07 -1.56 0.26 116.25 117.46 2o5j h VAL 1349Ca 0.09 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 2o5j h VAL 1349Cb 0.29 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.04 2o5j h VAL 1349CO -0.23 0.00 0.31 -0.33 0.02 0.00 0.00 177.57 177.34 2o5j h GLU 1350N -0.72 0.89 0.00 1.57 3.07 -1.40 -0.46 114.58 117.52 2o5j h GLU 1350Ca -0.01 -0.12 -0.03 0.00 -0.50 0.00 0.00 59.36 58.70 2o5j h GLU 1350Cb 0.72 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 28.46 2o5j h GLU 1350CO -0.25 0.70 -0.15 1.49 -1.40 0.00 0.00 179.01 179.40 2o5j h GLU 1351N 0.85 0.00 0.01 2.33 4.57 -0.32 -1.62 114.58 120.41 2o5j h GLU 1351Ca 0.22 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.31 2o5j h GLU 1351Cb 0.09 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.69 2o5j h GLU 1351CO -0.03 0.15 -0.34 0.82 -1.18 0.00 0.00 179.01 178.42 2o5j h ILE 1352N 0.00 1.54 0.00 2.32 2.04 -0.37 -3.25 117.51 119.79 2o5j h ILE 1352Ca -0.00 -2.06 -0.02 0.00 1.00 0.00 0.00 64.86 63.78 2o5j h ILE 1352Cb 0.34 2.83 -0.00 0.00 -0.74 0.00 0.00 36.82 39.25 2o5j h ILE 1352CO 0.02 0.57 -0.09 1.56 0.00 0.00 0.00 178.15 180.21 2o5j h GLN 1353N -0.46 0.00 -0.52 2.37 1.08 -0.75 -3.10 115.11 113.73 2o5j h GLN 1353Ca -0.05 0.00 0.10 0.00 -1.45 0.00 0.00 58.65 57.26 2o5j h GLN 1353Cb 1.12 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 28.45 2o5j h GLN 1353CO 0.07 0.09 -0.16 0.87 -0.95 0.00 0.00 178.83 178.75 2o5j h LYS 1354N 0.00 -0.03 -0.30 1.46 1.79 -1.34 0.24 116.57 118.39 2o5j h LYS 1354Ca -0.00 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.38 2o5j h LYS 1354Cb 0.18 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 2o5j h LYS 1354CO 0.01 -0.02 -0.16 0.28 -1.08 0.00 0.00 179.45 178.48 2o5j h VAL 1355N -0.03 1.29 -0.41 0.50 2.07 -1.69 -2.56 116.25 115.42 2o5j h VAL 1355Ca 0.25 -1.26 -0.11 0.00 0.82 0.00 0.00 66.70 66.39 2o5j h VAL 1355Cb 0.41 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 2o5j h VAL 1355CO -0.55 0.40 -0.20 1.88 0.02 0.00 0.00 177.57 179.13 2o5j h TYR 1356N 0.38 0.91 -0.59 1.57 -1.99 -1.48 -2.47 116.97 113.30 2o5j h TYR 1356Ca 0.06 -0.20 -0.01 0.00 2.00 0.00 0.00 58.73 60.58 2o5j h TYR 1356Cb 0.68 -0.22 -0.03 0.00 2.00 0.00 0.00 36.73 39.17 2o5j h TYR 1356CO 0.06 0.93 0.31 0.00 -0.00 0.00 0.00 178.16 179.47 2o5j h ARG 1357N 0.71 0.82 0.00 4.88 3.08 -0.55 -1.11 114.38 122.22 2o5j h ARG 1357Ca 0.10 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2o5j h ARG 1357Cb 0.71 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.60 2o5j h ARG 1357CO 0.05 0.64 0.00 0.00 -1.07 0.00 0.00 179.97 179.59 2o5j n ALA 1358N -2.31 1.58 -0.57 0.04 0.00 -0.97 -2.00 120.51 116.29 2o5j n ALA 1358Ca 0.04 -0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.47 2o5j n ALA 1358Cb 0.09 -1.17 0.05 0.00 0.00 0.00 0.00 19.45 18.43 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 -1.36 2.01 0.00 0.00 1.13 -0.84 -5.00 117.38 113.31 2o5j n GLN 1359Ca 0.04 -1.82 0.00 0.00 -1.94 0.00 0.00 57.00 53.28 2o5j n GLN 1359Cb 0.10 -1.13 0.00 0.00 0.11 0.00 0.00 30.24 29.31 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 -0.80 3.15 3.77 1.08 0.00 -0.85 -5.02 105.19 106.52 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 -1.85 2.75 -0.65 1.61 1.01 -0.48 -4.96 120.40 117.83 2o5j s VAL 1361Ca 0.00 0.68 0.05 0.00 0.00 0.00 0.00 61.98 62.71 2o5j s VAL 1361Cb 0.00 -3.41 0.17 0.00 0.00 0.00 0.00 36.38 33.14 2o5j s VAL 1361CO 0.00 0.11 0.45 -0.54 0.00 0.00 0.00 175.10 175.12 2o5j s LYS 1362N -2.14 2.18 -0.16 2.72 1.02 -1.26 -3.93 119.74 118.17 2o5j s LYS 1362Ca 0.55 -3.10 -0.04 0.00 0.02 0.00 0.00 55.97 53.40 2o5j s LYS 1362Cb -0.37 -3.09 -0.03 0.00 -0.52 0.00 0.00 37.83 33.82 2o5j s LYS 1362CO 0.48 -1.29 -0.01 -0.48 -0.92 0.00 0.00 175.35 173.13 2o5j s LEU 1363N -1.13 3.41 0.28 3.17 0.05 -1.26 -2.01 118.68 121.18 2o5j s LEU 1363Ca 0.25 -0.06 -0.30 0.00 0.05 0.00 0.00 54.13 54.08 2o5j s LEU 1363Cb -0.05 -1.83 -0.13 0.00 -2.05 0.00 0.00 46.19 42.14 2o5j s LEU 1363CO -0.16 0.19 1.36 1.57 -0.55 0.00 0.00 176.35 178.77 2o5j n HIS 1364N 3.41 2.21 -0.15 3.48 -0.00 0.49 -4.86 115.22 119.80 2o5j n HIS 1364Ca -0.17 0.47 0.22 0.00 -0.00 0.00 0.00 57.72 58.24 2o5j n HIS 1364Cb 0.52 -2.45 0.62 0.00 -0.00 0.00 0.00 29.99 28.69 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 3.60 0.18 -0.62 0.26 3.45 -1.87 -2.87 116.42 118.55 2o5j h ASP 1365Ca -0.45 0.02 0.07 0.00 0.43 0.00 0.00 57.03 57.09 2o5j h ASP 1365Cb 1.28 -0.02 -0.08 0.00 -0.56 0.00 0.00 39.33 39.95 2o5j h ASP 1365CO 0.71 0.08 -0.33 0.29 -1.57 0.00 0.00 179.24 178.41 2o5j n LYS 1366N -4.40 -0.24 0.25 3.56 5.02 -1.26 -1.35 118.16 119.74 2o5j n LYS 1366Ca 0.16 0.94 -0.16 0.00 -2.02 0.00 0.00 58.31 57.22 2o5j n LYS 1366Cb 0.73 -1.38 -0.09 0.00 -0.02 0.00 0.00 35.03 34.27 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 -1.29 -0.94 2.13 3.86 -1.89 -1.78 115.15 115.25 2o5j h HIS 1367Ca 0.13 0.01 0.22 0.00 -1.16 0.00 0.00 60.37 59.57 2o5j h HIS 1367Cb 0.29 0.51 -0.12 0.00 1.06 0.00 0.00 27.41 29.14 2o5j h HIS 1367CO -0.61 -0.60 0.49 0.82 0.86 0.00 0.00 177.93 178.88 2o5j h ILE 1368N -0.89 0.54 0.72 2.45 2.04 -1.39 -2.12 117.51 118.87 2o5j h ILE 1368Ca -0.05 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.60 2o5j h ILE 1368Cb 0.78 -0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2o5j h ILE 1368CO -0.08 0.09 -0.45 -0.33 0.00 0.00 0.00 178.15 177.38 2o5j h GLU 1369N 0.52 -1.06 -0.94 2.37 5.08 -0.76 -0.78 114.58 119.01 2o5j h GLU 1369Ca 0.58 0.07 0.28 0.00 -1.00 0.00 0.00 59.36 59.30 2o5j h GLU 1369Cb 1.06 0.24 -0.16 0.00 0.50 0.00 0.00 28.75 30.40 2o5j h GLU 1369CO -0.48 -0.71 0.30 0.82 -1.00 0.00 0.00 179.01 177.94 2o5j h ILE 1370N -1.10 0.22 0.47 3.13 1.08 -0.66 0.12 117.51 120.77 2o5j h ILE 1370Ca -0.09 -0.06 -0.02 0.00 -0.39 0.00 0.00 64.86 64.30 2o5j h ILE 1370Cb 0.89 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.68 2o5j h ILE 1370CO 0.09 0.03 -0.23 0.58 -0.69 0.00 0.00 178.15 177.93 2o5j h VAL 1371N 0.17 0.00 -0.73 1.67 2.07 -1.27 -3.23 116.25 114.92 2o5j h VAL 1371Ca 0.63 -0.28 0.20 0.00 0.82 0.00 0.00 66.70 68.08 2o5j h VAL 1371Cb 1.39 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 2o5j h VAL 1371CO -0.71 0.00 0.52 1.62 0.02 0.00 0.00 177.57 179.02 2o5j h VAL 1372N -0.91 0.65 -0.52 2.57 3.04 -0.19 0.57 116.25 121.46 2o5j h VAL 1372Ca -0.06 -0.02 -0.00 0.00 -1.01 0.00 0.00 66.70 65.61 2o5j h VAL 1372Cb 0.49 0.60 -0.03 0.00 -2.01 0.00 0.00 31.29 30.34 2o5j h VAL 1372CO 0.11 0.01 0.32 -0.09 -1.01 0.00 0.00 177.57 176.90 2o5j h ARG 1373N 0.05 0.70 0.00 4.17 2.43 -0.83 -1.59 114.38 119.31 2o5j h ARG 1373Ca 0.35 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 2o5j h ARG 1373Cb 1.33 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2o5j h ARG 1373CO -0.02 0.50 0.00 1.04 -1.51 0.00 0.00 179.97 179.98 2o5j n GLN 1374N -4.69 0.13 0.00 0.20 1.13 0.18 -0.88 117.38 113.46 2o5j n GLN 1374Ca 0.03 0.52 0.14 0.00 -1.94 0.00 0.00 57.00 55.75 2o5j n GLN 1374Cb 0.05 -1.85 0.61 0.00 0.11 0.00 0.00 30.24 29.16 2o5j n GLN 1374CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 2o5j n MET 1375N -2.11 1.13 -2.69 -1.09 2.81 -0.60 -3.97 117.12 110.59 2o5j n MET 1375Ca 0.00 -0.49 -0.07 0.00 -1.81 0.00 0.00 57.70 55.33 2o5j n MET 1375Cb 0.11 -1.49 0.04 0.00 -0.71 0.00 0.00 33.22 31.16 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 -0.51 1.68 -0.15 0.03 2.81 -0.06 -1.82 117.12 119.10 2o5j n MET 1376Ca 0.18 -3.49 0.12 0.00 -1.81 0.00 0.00 57.70 52.69 2o5j n MET 1376Cb 0.28 -1.52 0.23 0.00 -0.71 0.00 0.00 33.22 31.50 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 -0.36 2.37 -4.42 0.03 4.81 -1.22 -4.96 118.16 114.40 2o5j n LYS 1377Ca 0.12 -2.06 -0.21 0.00 -0.87 0.00 0.00 58.31 55.29 2o5j n LYS 1377Cb 0.81 -1.49 -0.10 0.00 0.02 0.00 0.00 35.03 34.26 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 -1.61 1.87 0.20 5.64 1.51 -1.26 0.27 117.35 123.97 2o5j s TYR 1378Ca 0.37 -1.02 -0.23 0.00 -1.01 0.00 0.00 57.07 55.18 2o5j s TYR 1378Cb 0.22 -1.20 0.06 0.00 -0.11 0.00 0.00 41.96 40.93 2o5j s TYR 1378CO 0.31 -0.08 0.96 0.14 -1.11 0.00 0.00 175.55 175.77 2o5j s VAL 1379N -3.39 0.00 0.28 0.71 -7.23 -0.50 -3.78 120.40 106.49 2o5j s VAL 1379Ca 0.36 -0.70 0.08 0.00 -1.81 0.00 0.00 61.98 59.92 2o5j s VAL 1379Cb 0.08 -2.40 -0.04 0.00 0.56 0.00 0.00 36.38 34.58 2o5j s VAL 1379CO 0.15 0.00 0.16 -0.70 -0.31 0.00 0.00 175.10 174.41 2o5j s GLU 1380N -2.82 2.70 -0.11 4.82 2.56 -0.60 -0.64 118.70 124.60 2o5j s GLU 1380Ca 0.16 -1.22 -0.02 0.00 0.00 0.00 0.00 54.97 53.90 2o5j s GLU 1380Cb -0.02 -2.43 -0.03 0.00 2.00 0.00 0.00 34.13 33.65 2o5j s GLU 1380CO 0.05 0.32 -0.05 0.08 -0.56 0.00 0.00 175.26 175.09 2o5j s VAL 1381N -2.23 3.79 -0.01 3.70 1.01 -0.88 -0.67 120.40 125.10 2o5j s VAL 1381Ca 0.34 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.93 2o5j s VAL 1381Cb -0.07 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.67 2o5j s VAL 1381CO 0.24 0.55 0.03 0.41 0.00 0.00 0.00 175.10 176.32 2o5j n THR 1382N 2.91 0.09 -3.63 3.92 -1.04 0.29 -3.69 114.28 113.13 2o5j n THR 1382Ca -0.18 -0.08 -0.29 0.00 -2.04 0.00 0.00 64.05 61.46 2o5j n THR 1382Cb 0.53 -0.30 -0.14 0.00 -1.82 0.00 0.00 70.33 68.59 2o5j n THR 1382CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2o5j s ASP 1383N -2.83 3.65 1.21 8.00 -1.08 -0.72 -4.94 116.67 119.97 2o5j s ASP 1383Ca -0.01 -1.76 -0.14 0.00 -0.52 0.00 0.00 52.55 50.12 2o5j s ASP 1383Cb 0.01 -0.65 0.30 0.00 -1.46 0.00 0.00 42.92 41.12 2o5j s ASP 1383CO 0.10 -0.38 1.01 -2.84 0.52 0.00 0.00 175.17 173.58 2o5j s PRO 1384N 1.50 -1.25 0.08 4.34 0.02 -1.26 -2.94 135.00 135.48 2o5j s PRO 1384Ca 0.12 0.73 0.00 0.00 0.02 0.00 0.00 61.00 61.87 2o5j s PRO 1384Cb -0.19 -1.52 0.00 0.00 0.02 0.00 0.00 34.50 32.81 2o5j s PRO 1384CO -0.21 -3.92 0.00 0.41 -0.33 0.00 0.00 177.00 172.96 2o5j n GLY 1385N 0.87 -1.33 0.12 0.52 0.00 -1.26 -4.81 105.19 99.29 2o5j n GLY 1385Ca 0.03 0.30 -0.21 0.00 0.00 0.00 0.00 46.02 46.14 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 0.20 -4.26 1.61 1.82 -1.96 -3.48 116.42 110.35 2o5j h ASP 1386Ca 0.00 -0.73 -0.37 0.00 -0.39 0.00 0.00 57.03 55.54 2o5j h ASP 1386Cb 0.00 -0.07 -0.19 0.00 0.68 0.00 0.00 39.33 39.76 2o5j h ASP 1386CO 0.00 1.59 -0.75 -0.44 -1.61 0.00 0.00 179.24 178.03 2o5j s SER 1387N -6.92 1.70 0.60 2.28 0.01 -1.26 -5.13 113.70 104.98 2o5j s SER 1387Ca -0.24 -0.78 -0.18 0.00 1.31 0.00 0.00 55.95 56.06 2o5j s SER 1387Cb 0.05 -0.03 -0.12 0.00 0.21 0.00 0.00 66.02 66.13 2o5j s SER 1387CO 0.69 -0.19 0.04 0.54 0.41 0.00 0.00 173.24 174.73 2o5j n ARG 1388N 0.67 0.16 0.00 12.44 5.12 -1.26 -4.61 116.66 129.18 2o5j n ARG 1388Ca -0.17 0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.82 2o5j n ARG 1388Cb 0.57 -1.27 0.00 0.00 -1.16 0.00 0.00 32.46 30.60 2o5j n ARG 1388CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 2o5j n LEU 1389N 1.77 0.00 -4.48 0.55 7.94 -1.26 -4.50 117.00 117.02 2o5j n LEU 1389Ca 0.08 0.12 -0.44 0.00 -1.11 0.00 0.00 56.01 54.67 2o5j n LEU 1389Cb 0.48 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.34 2o5j n LEU 1389CO 0.53 0.00 2.03 0.18 -1.11 0.00 0.00 177.39 179.01 2o5j n LEU 1390N -0.18 1.31 -3.59 -1.96 4.77 -1.24 -4.00 117.00 112.11 2o5j n LEU 1390Ca 0.00 0.10 -0.14 0.00 -0.03 0.00 0.00 56.01 55.94 2o5j n LEU 1390Cb 0.00 -1.18 -0.06 0.00 -2.33 0.00 0.00 43.42 39.85 2o5j n LEU 1390CO 0.00 -0.96 0.53 -1.61 -1.33 0.00 0.00 177.39 174.02 2o5j s GLU 1391N 7.86 0.81 -0.30 3.23 2.02 -1.26 -4.76 118.70 126.31 2o5j s GLU 1391Ca 1.18 0.61 -0.04 0.00 0.02 0.00 0.00 54.97 56.74 2o5j s GLU 1391Cb -0.90 0.39 0.03 0.00 0.10 0.00 0.00 34.13 33.76 2o5j s GLU 1391CO 0.45 -0.17 0.03 0.20 0.02 0.00 0.00 175.26 175.79 2o5j s GLY 1392N -0.28 1.76 0.25 -1.39 0.00 -1.26 -2.07 107.32 104.32 2o5j s GLY 1392Ca -0.03 -1.63 0.02 0.00 0.00 0.00 0.00 44.72 43.08 2o5j s GLY 1392CO 0.02 0.67 0.18 1.20 0.00 0.00 0.00 173.10 175.18 2o5j s GLN 1393N 1.36 1.40 -0.26 2.90 -1.52 0.19 -4.96 119.66 118.78 2o5j s GLN 1393Ca -0.01 -1.77 -0.33 0.00 -1.95 0.00 0.00 55.36 51.30 2o5j s GLN 1393Cb -0.18 0.29 -0.09 0.00 -0.22 0.00 0.00 33.01 32.80 2o5j s GLN 1393CO 0.00 -0.48 2.14 0.28 -0.25 0.00 0.00 175.29 176.98 2o5j n VAL 1394N -0.40 0.31 -0.13 1.09 0.31 -1.26 -1.41 118.33 116.85 2o5j n VAL 1394Ca 0.04 -0.29 -0.11 0.00 -0.01 0.00 0.00 64.34 63.96 2o5j n VAL 1394Cb 0.65 -1.98 -0.08 0.00 -0.91 0.00 0.00 33.84 31.51 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 12.62 -1.53 -2.06 7.52 5.85 -0.43 0.20 115.31 137.48 2o5j h LEU 1395Ca -0.36 0.20 0.06 0.00 0.84 0.00 0.00 57.88 58.62 2o5j h LEU 1395Cb 1.29 0.63 -0.01 0.00 0.37 0.00 0.00 40.66 42.94 2o5j h LEU 1395CO 0.99 -0.32 0.15 -0.08 -0.34 0.00 0.00 178.44 178.84 2o5j h GLU 1396N -0.30 0.00 0.00 1.25 4.22 -1.91 0.14 114.58 117.99 2o5j h GLU 1396Ca 0.06 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.48 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 -0.50 0.00 -0.10 -0.22 -2.18 0.00 0.00 179.01 176.00 2o5j h LYS 1397N 0.00 0.00 0.01 1.92 3.64 -0.95 -2.17 116.57 119.03 2o5j h LYS 1397Ca 0.09 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.23 2o5j h LYS 1397Cb 0.39 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 2o5j h LYS 1397CO -0.00 0.10 -1.24 -1.49 -2.27 0.00 0.00 179.45 174.55 2o5j h TRP 1398N 0.00 0.05 0.00 1.91 4.06 -0.08 -3.12 115.95 118.77 2o5j h TRP 1398Ca -0.00 -0.04 -0.05 0.00 2.06 0.00 0.00 58.89 60.86 2o5j h TRP 1398Cb 0.39 -0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.54 2o5j h TRP 1398CO 0.00 1.04 -0.23 -0.44 -3.56 0.00 0.00 178.44 175.25 2o5j h ASP 1399N 0.01 0.00 0.07 -3.49 3.32 -1.00 -1.06 116.42 114.26 2o5j h ASP 1399Ca -0.11 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 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 0.12 0.23 -0.03 0.58 -1.72 0.00 0.00 179.24 178.42 2o5j h VAL 1400N 0.00 1.22 0.65 -1.35 2.07 -1.47 -2.27 116.25 115.10 2o5j h VAL 1400Ca -0.00 -1.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.28 2o5j h VAL 1400Cb 0.44 1.99 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2o5j h VAL 1400CO 0.03 0.29 -0.40 -0.08 0.02 0.00 0.00 177.57 177.43 2o5j h GLU 1401N -0.66 -0.94 -0.96 1.57 4.22 -1.45 -2.37 114.58 113.98 2o5j h GLU 1401Ca -0.01 0.06 0.13 0.00 0.08 0.00 0.00 59.36 59.62 2o5j h GLU 1401Cb 0.55 0.21 -0.08 0.00 0.50 0.00 0.00 28.75 29.93 2o5j h GLU 1401CO 0.02 -0.63 0.61 0.00 -2.18 0.00 0.00 179.01 176.83 2o5j h ALA 1402N -1.33 1.63 0.67 2.92 0.00 -1.34 0.47 119.26 122.28 2o5j h ALA 1402Ca -0.09 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2o5j h ALA 1402Cb 0.78 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2o5j h ALA 1402CO 0.09 0.13 -0.50 -0.07 0.00 0.00 0.00 179.25 178.91 2o5j h LEU 1403N 0.89 -1.30 -0.81 0.00 3.38 -1.26 -2.52 115.31 113.70 2o5j h LEU 1403Ca 0.48 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.50 2o5j h LEU 1403Cb 0.55 0.40 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 2o5j h LEU 1403CO -0.24 -0.72 -0.14 0.78 0.09 0.00 0.00 178.44 178.21 2o5j h ASN 1404N -1.12 0.00 0.78 -0.43 4.21 -1.21 -1.69 115.58 116.13 2o5j h ASN 1404Ca -0.09 0.00 -0.09 0.00 1.21 0.00 0.00 56.30 57.33 2o5j h ASN 1404Cb 0.93 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.11 2o5j h ASN 1404CO 0.04 0.14 -0.43 -0.08 -1.29 0.00 0.00 177.43 175.81 2o5j h GLU 1405N 0.00 0.00 0.00 0.81 4.57 -0.75 0.14 114.58 119.35 2o5j h GLU 1405Ca -0.00 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 57.97 2o5j h GLU 1405Cb 0.82 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.37 2o5j h GLU 1405CO 0.02 0.43 -1.79 -2.13 -1.18 0.00 0.00 179.01 174.35 2o5j n ARG 1406N -3.61 2.04 -0.01 1.92 0.63 -0.96 -4.31 116.66 112.37 2o5j n ARG 1406Ca -0.00 -0.00 -0.00 0.00 -0.92 0.00 0.00 57.85 56.92 2o5j n ARG 1406Cb 0.53 -1.30 -0.00 0.00 0.45 0.00 0.00 32.46 32.14 2o5j n ARG 1406CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2o5j h LEU 1407N 0.00 0.00 0.37 6.15 4.07 -1.38 -3.44 115.31 121.07 2o5j h LEU 1407Ca -0.31 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.63 2o5j h LEU 1407Cb 1.70 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.45 2o5j h LEU 1407CO 0.01 0.05 -0.18 0.40 -1.08 0.00 0.00 178.44 177.65 2o5j h ILE 1408N -0.07 0.03 -3.09 1.22 2.04 -1.67 -3.44 117.51 112.53 2o5j h ILE 1408Ca 0.00 -0.65 -0.61 0.00 1.00 0.00 0.00 64.86 64.60 2o5j h ILE 1408Cb 0.03 0.05 -0.08 0.00 -0.74 0.00 0.00 36.82 36.09 2o5j h ILE 1408CO 0.00 0.01 -0.28 0.00 0.00 0.00 0.00 178.15 177.88 2o5j s ALA 1409N -3.81 3.66 1.02 1.87 0.00 0.47 -5.04 121.76 119.93 2o5j s ALA 1409Ca -0.08 -0.36 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 2o5j s ALA 1409Cb 0.01 -2.35 0.04 0.00 0.00 0.00 0.00 23.12 20.82 2o5j s ALA 1409CO 0.23 0.31 0.20 -0.85 0.00 0.00 0.00 175.76 175.65 2o5j n GLU 1410N 2.66 -0.71 -1.63 0.00 0.28 -1.26 -3.48 120.64 116.50 2o5j n GLU 1410Ca -0.13 -0.31 -0.00 0.00 -0.16 0.00 0.00 57.16 56.55 2o5j n GLU 1410Cb 0.52 -0.24 0.00 0.00 1.43 0.00 0.00 31.44 33.15 2o5j n GLU 1410CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2o5j n GLY 1411N 2.58 -2.13 3.56 -1.84 0.00 -1.26 -4.84 105.19 101.25 2o5j n GLY 1411Ca 0.03 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 2o5j n GLY 1411CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2o5j s LYS 1412N -0.54 2.73 -1.01 1.61 2.36 -1.26 -4.74 119.74 118.88 2o5j s LYS 1412Ca 0.01 -0.07 -0.12 0.00 -2.55 0.00 0.00 55.97 53.24 2o5j s LYS 1412Cb -0.00 -4.81 0.24 0.00 -1.05 0.00 0.00 37.83 32.21 2o5j s LYS 1412CO 0.08 -2.96 1.01 0.99 1.55 0.00 0.00 175.35 176.02 2o5j s THR 1413N 8.93 5.76 0.04 3.43 2.01 -1.26 -5.03 115.64 129.51 2o5j s THR 1413Ca 0.64 -2.96 -0.34 0.00 0.31 0.00 0.00 61.69 59.34 2o5j s THR 1413Cb -0.08 -4.58 -0.13 0.00 0.01 0.00 0.00 72.50 67.72 2o5j s THR 1413CO 0.06 -1.17 1.73 -2.65 -0.69 0.00 0.00 174.62 171.90 2o5j n PRO 1414N 3.50 2.16 -3.25 4.92 -0.02 -1.26 -4.84 135.00 136.21 2o5j n PRO 1414Ca 0.21 0.79 -0.46 0.00 -2.02 0.00 0.00 63.50 62.02 2o5j n PRO 1414Cb 0.43 -2.60 -0.02 0.00 -0.02 0.00 0.00 33.50 31.29 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 2.51 5.48 -0.29 -1.45 -7.23 -1.25 -4.62 120.40 113.55 2o5j s VAL 1415Ca 0.86 -2.42 -0.29 0.00 -1.81 0.00 0.00 61.98 58.31 2o5j s VAL 1415Cb -0.69 -4.56 -0.00 0.00 0.56 0.00 0.00 36.38 31.70 2o5j s VAL 1415CO 0.45 -1.15 1.34 0.00 -0.31 0.00 0.00 175.10 175.42 2o5j s ALA 1416N 0.50 3.35 0.43 1.32 0.00 -1.15 -4.90 121.76 121.31 2o5j s ALA 1416Ca 0.23 0.14 0.06 0.00 0.00 0.00 0.00 51.96 52.39 2o5j s ALA 1416Cb -0.09 -3.79 -0.05 0.00 0.00 0.00 0.00 23.12 19.20 2o5j s ALA 1416CO -0.09 -1.80 0.14 1.67 0.00 0.00 0.00 175.76 175.68 2o5j s TRP 1417N 4.49 2.43 -0.08 0.00 -2.14 -1.26 0.11 118.94 122.48 2o5j s TRP 1417Ca 0.58 -0.67 0.01 0.00 2.66 0.00 0.00 56.10 58.68 2o5j s TRP 1417Cb -0.17 -1.88 0.02 0.00 -3.10 0.00 0.00 33.47 28.34 2o5j s TRP 1417CO 0.24 0.20 -0.08 0.15 -2.66 0.00 0.00 176.95 174.81 2o5j s LYS 1418N -3.88 1.37 0.05 3.25 1.02 0.15 -4.84 119.74 116.87 2o5j s LYS 1418Ca 0.35 -0.24 -0.34 0.00 0.02 0.00 0.00 55.97 55.76 2o5j s LYS 1418Cb 0.05 -1.35 -0.13 0.00 -0.52 0.00 0.00 37.83 35.88 2o5j s LYS 1418CO 0.19 -0.15 1.72 -2.30 -0.92 0.00 0.00 175.35 173.89 2o5j n PRO 1419N 4.48 2.20 -4.23 -1.68 -0.02 -1.26 -1.56 135.00 132.93 2o5j n PRO 1419Ca -0.17 0.80 -0.34 0.00 -2.02 0.00 0.00 63.50 61.77 2o5j n PRO 1419Cb 0.51 -2.61 -0.14 0.00 -0.02 0.00 0.00 33.50 31.24 2o5j n PRO 1419CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2o5j s LEU 1420N 2.35 2.96 -0.28 2.45 1.43 -1.25 -4.86 118.68 121.49 2o5j s LEU 1420Ca 0.85 -0.30 -0.26 0.00 -1.03 0.00 0.00 54.13 53.38 2o5j s LEU 1420Cb -0.67 -1.73 0.01 0.00 0.03 0.00 0.00 46.19 43.82 2o5j s LEU 1420CO 0.44 0.07 0.93 -0.22 0.23 0.00 0.00 176.35 177.79 2o5j s LEU 1421N 0.94 4.05 -0.04 1.79 2.96 -1.26 -4.57 118.68 122.55 2o5j s LEU 1421Ca -0.01 1.01 0.06 0.00 -0.22 0.00 0.00 54.13 54.97 2o5j s LEU 1421Cb -0.15 -3.33 -0.01 0.00 0.50 0.00 0.00 46.19 43.21 2o5j s LEU 1421CO 0.01 -0.67 -0.21 -0.04 -1.32 0.00 0.00 176.35 174.12 2o5j s MET 1422N 3.16 2.00 0.39 1.98 -1.94 -0.76 -4.97 119.30 119.16 2o5j s MET 1422Ca 0.39 -0.75 -0.11 0.00 -1.71 0.00 0.00 55.69 53.52 2o5j s MET 1422Cb -0.14 -1.77 -0.07 0.00 2.01 0.00 0.00 34.83 34.86 2o5j s MET 1422CO 0.11 0.35 0.75 0.20 -0.01 0.00 0.00 175.02 176.42 2o5j s GLY 1423N -0.19 1.99 0.04 -0.03 0.00 -1.26 -4.39 107.32 103.49 2o5j s GLY 1423Ca -0.00 -0.19 -0.09 0.00 0.00 0.00 0.00 44.72 44.44 2o5j s GLY 1423CO 0.02 -0.00 0.50 1.55 0.00 0.00 0.00 173.10 175.17 2o5j n VAL 1424N -1.16 -0.19 -0.04 1.40 3.14 -1.17 -0.58 118.33 119.73 2o5j n VAL 1424Ca 0.02 0.78 -0.08 0.00 -2.96 0.00 0.00 64.34 62.10 2o5j n VAL 1424Cb 0.54 -0.98 -0.06 0.00 -1.06 0.00 0.00 33.84 32.28 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 -0.47 1.55 2.02 -1.83 -1.26 112.91 112.92 2o5j h THR 1425Ca 0.04 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.30 2o5j h THR 1425Cb 0.11 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.50 2o5j h THR 1425CO -0.26 0.00 0.32 0.50 0.37 0.00 0.00 175.52 176.45 2o5j h LYS 1426N -0.28 0.31 -0.62 6.66 3.64 -1.21 0.26 116.57 125.33 2o5j h LYS 1426Ca 0.03 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 2o5j h LYS 1426Cb 0.36 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 2o5j h LYS 1426CO -0.28 0.21 0.01 1.03 -2.27 0.00 0.00 179.45 178.15 2o5j h SER 1427N 0.32 1.05 -0.22 4.20 0.87 0.10 -1.52 113.55 118.36 2o5j h SER 1427Ca 0.21 -0.29 -0.18 0.00 -1.23 0.00 0.00 61.79 60.30 2o5j h SER 1427Cb 0.42 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 2o5j h SER 1427CO -0.05 1.09 -0.56 0.00 -0.53 0.00 0.00 176.83 176.78 2o5j h ALA 1428N 1.01 0.36 0.04 6.23 0.00 -0.28 -3.25 119.26 123.38 2o5j h ALA 1428Ca 0.18 -0.52 0.02 0.00 0.00 0.00 0.00 54.91 54.59 2o5j h ALA 1428Cb 0.54 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 2o5j h ALA 1428CO 0.03 0.59 -0.48 -0.07 0.00 0.00 0.00 179.25 179.31 2o5j h LEU 1429N 0.51 -1.47 -7.68 0.00 4.07 -0.83 -3.35 115.31 106.56 2o5j h LEU 1429Ca -0.01 0.17 -0.72 0.00 0.08 0.00 0.00 57.88 57.40 2o5j h LEU 1429Cb 1.18 0.56 -0.32 0.00 1.08 0.00 0.00 40.66 43.16 2o5j h LEU 1429CO 0.12 -0.51 -0.28 -0.94 -1.08 0.00 0.00 178.44 175.76 2o5j s SER 1430N -4.74 5.63 0.00 -0.43 1.04 -0.59 -4.76 113.70 109.86 2o5j s SER 1430Ca -0.16 -2.66 0.00 0.00 0.48 0.00 0.00 55.95 53.61 2o5j s SER 1430Cb 0.07 -1.95 0.00 0.00 0.10 0.00 0.00 66.02 64.24 2o5j s SER 1430CO 0.62 -0.46 0.00 1.07 0.98 0.00 0.00 173.24 175.45 2o5j n THR 1431N 3.83 0.00 0.00 2.02 5.66 -1.23 -4.68 114.28 119.87 2o5j n THR 1431Ca 0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.07 2o5j n THR 1431Cb 0.40 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.18 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 0.00 0.00 -1.04 1.09 3.00 -1.26 -4.88 118.16 115.07 2o5j n LYS 1432Ca 0.00 0.45 -0.34 0.00 -0.00 0.00 0.00 58.31 58.42 2o5j n LYS 1432Cb 0.00 -1.01 0.11 0.00 0.00 0.00 0.00 35.03 34.13 2o5j n LYS 1432CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2o5j n SER 1433N -1.84 -0.47 -0.10 3.14 2.88 -1.26 -4.96 113.62 111.01 2o5j n SER 1433Ca 0.00 0.51 -0.11 0.00 -1.33 0.00 0.00 58.87 57.94 2o5j n SER 1433Cb 0.00 -1.34 -0.15 0.00 -0.75 0.00 0.00 64.21 61.96 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 -3.19 0.10 -0.29 0.66 2.14 -1.26 -4.29 117.44 111.31 2o5j n TRP 1434Ca 0.11 0.03 0.00 0.00 2.07 0.00 0.00 57.50 59.71 2o5j n TRP 1434Cb 0.51 -1.02 0.07 0.00 -0.81 0.00 0.00 31.31 30.06 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 0.00 -1.01 -0.41 5.67 4.07 -1.96 1.01 115.31 122.68 2o5j h LEU 1435Ca -0.53 0.26 -0.01 0.00 0.08 0.00 0.00 57.88 57.68 2o5j h LEU 1435Cb 2.18 0.58 -0.02 0.00 1.08 0.00 0.00 40.66 44.49 2o5j h LEU 1435CO 0.02 -0.29 0.23 0.28 -1.08 0.00 0.00 178.44 177.60 2o5j h SER 1436N -0.04 0.51 0.26 -0.43 0.02 -1.93 -2.97 113.55 108.97 2o5j h SER 1436Ca 0.35 -0.08 -0.10 0.00 -0.84 0.00 0.00 61.79 61.11 2o5j h SER 1436Cb 0.60 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 2o5j h SER 1436CO -0.85 0.44 -0.41 0.00 -1.14 0.00 0.00 176.83 174.88 2o5j h ALA 1437N 1.09 1.14 0.00 3.77 0.00 -0.55 -2.34 119.26 122.37 2o5j h ALA 1437Ca 0.14 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2o5j h ALA 1437Cb 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2o5j h ALA 1437CO -0.02 0.58 0.00 0.00 0.00 0.00 0.00 179.25 179.80 2o5j n ALA 1438N -2.47 1.42 0.03 0.00 0.00 0.31 -2.97 120.51 116.82 2o5j n ALA 1438Ca -0.02 0.02 -0.19 0.00 0.00 0.00 0.00 53.44 53.26 2o5j n ALA 1438Cb 0.47 -1.22 -0.14 0.00 0.00 0.00 0.00 19.45 18.56 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 0.40 0.00 0.00 0.02 -1.37 -3.39 113.55 109.22 2o5j h SER 1439Ca 0.00 -0.93 0.00 0.00 -0.84 0.00 0.00 61.79 60.02 2o5j h SER 1439Cb 0.18 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.59 2o5j h SER 1439CO 0.00 1.30 0.00 0.33 -1.14 0.00 0.00 176.83 177.32 2o5j n PHE 1440N -4.22 0.00 0.00 3.45 -0.00 -1.16 -4.85 117.46 110.69 2o5j n PHE 1440Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.32 2o5j n PHE 1440Cb 0.75 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.23 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 -0.64 0.00 -3.93 -4.13 0.00 -1.25 -4.54 117.38 102.89 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 -2.36 4.85 0.35 1.69 3.84 -1.26 -4.92 114.94 117.12 2o5j s ASN 1442Ca 0.00 -1.38 0.11 0.00 0.21 0.00 0.00 52.86 51.80 2o5j s ASN 1442Cb 0.00 -1.69 0.89 0.00 -0.55 0.00 0.00 41.25 39.90 2o5j s ASN 1442CO 0.00 -0.27 1.79 0.71 -2.79 0.00 0.00 177.10 176.53 2o5j h THR 1443N 6.51 0.65 -0.16 -5.21 1.35 -1.80 0.55 112.91 114.80 2o5j h THR 1443Ca -0.20 -0.21 0.05 0.00 -0.55 0.00 0.00 66.41 65.50 2o5j h THR 1443Cb 1.06 -0.01 -0.07 0.00 -1.73 0.00 0.00 68.15 67.39 2o5j h THR 1443CO 0.53 0.11 -0.38 0.74 -0.25 0.00 0.00 175.52 176.27 2o5j h THR 1444N 0.61 0.19 0.22 6.82 2.02 -1.93 -2.38 112.91 118.46 2o5j h THR 1444Ca 0.57 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.74 2o5j h THR 1444Cb 1.10 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 2o5j h THR 1444CO -0.33 0.00 -0.10 -0.74 0.37 0.00 0.00 175.52 174.71 2o5j h HIS 1445N -0.44 -0.27 -0.91 3.16 2.76 -1.71 -3.07 115.15 114.66 2o5j h HIS 1445Ca 0.09 -0.01 0.16 0.00 -2.20 0.00 0.00 60.37 58.42 2o5j h HIS 1445Cb 0.60 0.09 -0.16 0.00 1.55 0.00 0.00 27.41 29.48 2o5j h HIS 1445CO -0.47 0.10 -0.29 0.28 -1.30 0.00 0.00 177.93 176.24 2o5j n VAL 1446N -4.97 -0.43 0.05 5.26 0.31 0.10 -1.21 118.33 117.44 2o5j n VAL 1446Ca -0.07 2.11 -0.20 0.00 -0.01 0.00 0.00 64.34 66.17 2o5j n VAL 1446Cb 0.25 -2.86 -0.12 0.00 -0.91 0.00 0.00 33.84 30.19 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 0.75 -0.64 7.52 4.07 -1.56 -3.01 115.31 122.43 2o5j h LEU 1447Ca 0.38 -0.79 0.11 0.00 0.08 0.00 0.00 57.88 57.66 2o5j h LEU 1447Cb 0.61 -0.23 -0.12 0.00 1.08 0.00 0.00 40.66 42.00 2o5j h LEU 1447CO -0.92 1.45 -0.34 0.74 -1.08 0.00 0.00 178.44 178.29 2o5j h THR 1448N 0.13 0.15 0.10 0.22 2.02 -1.06 0.20 112.91 114.67 2o5j h THR 1448Ca -0.13 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 2o5j h THR 1448Cb 1.64 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 2o5j h THR 1448CO 0.18 0.00 -0.05 -0.08 0.37 0.00 0.00 175.52 175.95 2o5j h GLU 1449N -0.14 -0.13 -0.11 6.66 4.57 -1.61 -2.76 114.58 121.07 2o5j h GLU 1449Ca 0.25 0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.47 2o5j h GLU 1449Cb 0.56 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2o5j h GLU 1449CO -0.72 0.10 0.11 0.00 -1.18 0.00 0.00 179.01 177.32 2o5j h ALA 1450N 0.54 1.76 0.08 2.92 0.00 -1.20 -2.83 119.26 120.53 2o5j h ALA 1450Ca -0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2o5j h ALA 1450Cb 0.28 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2o5j h ALA 1450CO 0.02 -0.16 -0.04 0.00 0.00 0.00 0.00 179.25 179.07 2o5j h ALA 1451N 1.88 -0.20 -0.05 0.00 0.00 -0.52 -2.00 119.26 118.37 2o5j h ALA 1451Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2o5j h ALA 1451Cb 0.27 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2o5j h ALA 1451CO -0.00 -0.19 -0.03 -0.89 0.00 0.00 0.00 179.25 178.14 2o5j n ILE 1452N -3.32 -0.03 -2.74 0.00 5.41 -1.05 -2.06 119.36 115.57 2o5j n ILE 1452Ca -0.01 0.48 -0.42 0.00 1.00 0.00 0.00 62.75 63.79 2o5j n ILE 1452Cb 0.04 -0.62 -0.04 0.00 -0.71 0.00 0.00 39.64 38.31 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 -3.61 3.00 -0.96 -1.39 0.00 -1.08 -4.56 121.76 113.16 2o5j s ALA 1453Ca -0.01 -1.53 -0.26 0.00 0.00 0.00 0.00 51.96 50.16 2o5j s ALA 1453Cb 0.01 -3.98 -0.23 0.00 0.00 0.00 0.00 23.12 18.92 2o5j s ALA 1453CO 0.03 -2.87 2.56 0.41 0.00 0.00 0.00 175.76 175.89 2o5j n GLY 1454N 5.29 -0.44 3.71 0.00 0.00 -0.87 -4.64 105.19 108.24 2o5j n GLY 1454Ca -0.00 0.85 -0.38 0.00 0.00 0.00 0.00 46.02 46.50 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 8.52 4.27 -0.67 1.61 -0.14 -0.75 -4.94 119.74 127.64 2o5j s LYS 1455Ca 1.32 0.28 -0.15 0.00 -1.36 0.00 0.00 55.97 56.06 2o5j s LYS 1455Cb -1.07 -3.46 0.17 0.00 -1.68 0.00 0.00 37.83 31.79 2o5j s LYS 1455CO 0.48 0.12 0.63 0.15 -0.76 0.00 0.00 175.35 175.97 2o5j s LYS 1456N 0.78 3.27 -0.84 1.68 1.02 -1.26 -2.77 119.74 121.62 2o5j s LYS 1456Ca 0.21 -2.05 -0.25 0.00 0.02 0.00 0.00 55.97 53.91 2o5j s LYS 1456Cb -0.14 -4.36 -0.02 0.00 -0.52 0.00 0.00 37.83 32.78 2o5j s LYS 1456CO 0.08 -1.32 1.82 0.34 -0.92 0.00 0.00 175.35 175.35 2o5j s ASP 1457N 2.95 5.42 0.04 2.83 -1.08 0.19 -4.87 116.67 122.15 2o5j s ASP 1457Ca 0.10 -0.52 -0.30 0.00 -0.52 0.00 0.00 52.55 51.31 2o5j s ASP 1457Cb -0.21 -2.55 -0.07 0.00 -1.46 0.00 0.00 42.92 38.63 2o5j s ASP 1457CO -0.02 -2.43 1.51 -1.61 0.52 0.00 0.00 175.17 173.13 2o5j s GLU 1458N 6.67 4.25 -0.54 4.34 2.02 -1.26 -2.77 118.70 131.40 2o5j s GLU 1458Ca 0.64 2.13 -0.27 0.00 0.02 0.00 0.00 54.97 57.49 2o5j s GLU 1458Cb -0.07 -3.56 0.03 0.00 0.10 0.00 0.00 34.13 30.63 2o5j s GLU 1458CO 0.04 -0.64 1.09 -0.51 0.02 0.00 0.00 175.26 175.26 2o5j s LEU 1459N 2.40 3.71 -0.04 1.80 1.02 -1.20 -4.94 118.68 121.43 2o5j s LEU 1459Ca 0.68 0.06 -0.03 0.00 0.02 0.00 0.00 54.13 54.86 2o5j s LEU 1459Cb -0.35 -3.15 0.01 0.00 0.02 0.00 0.00 46.19 42.71 2o5j s LEU 1459CO 0.29 -1.33 0.11 0.27 0.02 0.00 0.00 176.35 175.71 2o5j s ILE 1460N 4.48 -0.01 0.00 -0.59 -5.25 -1.26 -5.00 121.20 113.57 2o5j s ILE 1460Ca 0.40 0.03 0.00 0.00 -0.99 0.00 0.00 60.65 60.09 2o5j s ILE 1460Cb -0.09 -0.16 0.00 0.00 2.95 0.00 0.00 42.46 45.16 2o5j s ILE 1460CO 0.25 0.01 0.00 0.61 -1.79 0.00 0.00 174.94 174.02 2o5j n GLY 1461N 3.20 2.29 0.13 6.27 0.00 -1.26 -4.80 105.19 111.03 2o5j n GLY 1461Ca -0.14 -1.87 -0.20 0.00 0.00 0.00 0.00 46.02 43.81 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 0.48 0.77 0.99 3.38 -1.87 -3.29 115.31 115.76 2o5j h LEU 1462Ca 0.00 -0.79 -0.03 0.00 0.09 0.00 0.00 57.88 57.15 2o5j h LEU 1462Cb 0.00 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 2o5j h LEU 1462CO 0.00 1.68 -0.46 0.50 0.09 0.00 0.00 178.44 180.25 2o5j h LYS 1463N 0.08 -1.10 -0.24 1.13 3.64 -1.90 -1.56 116.57 116.63 2o5j h LYS 1463Ca -0.34 0.08 0.04 0.00 -1.27 0.00 0.00 60.65 59.16 2o5j h LYS 1463Cb 2.06 0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 34.10 2o5j h LYS 1463CO 0.15 -0.74 0.02 1.05 -2.27 0.00 0.00 179.45 177.67 2o5j h GLU 1464N -1.14 0.10 0.00 1.90 4.11 -1.87 -2.32 114.58 115.36 2o5j h GLU 1464Ca -0.10 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.32 2o5j h GLU 1464Cb 0.92 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2o5j h GLU 1464CO 0.11 0.07 0.00 -0.91 0.07 0.00 0.00 179.01 178.35 2o5j h ASN 1465N 0.11 0.00 0.06 3.06 4.21 -1.62 -2.73 115.58 118.67 2o5j h ASN 1465Ca 0.11 0.00 -0.19 0.00 1.21 0.00 0.00 56.30 57.43 2o5j h ASN 1465Cb 0.13 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 37.34 2o5j h ASN 1465CO -0.17 0.00 -0.79 0.58 -1.29 0.00 0.00 177.43 175.77 2o5j h VAL 1466N 0.00 1.43 -0.87 2.81 2.07 -0.71 -2.52 116.25 118.45 2o5j h VAL 1466Ca 0.00 -2.29 0.23 0.00 0.82 0.00 0.00 66.70 65.46 2o5j h VAL 1466Cb 0.31 2.80 -0.13 0.00 -1.52 0.00 0.00 31.29 32.74 2o5j h VAL 1466CO 0.00 0.67 0.29 0.40 0.02 0.00 0.00 177.57 178.94 2o5j h ILE 1467N -0.11 0.38 0.00 4.57 2.04 -1.35 1.09 117.51 124.13 2o5j h ILE 1467Ca -0.12 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 2o5j h ILE 1467Cb 1.53 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2o5j h ILE 1467CO 0.15 0.05 -0.10 -0.07 0.00 0.00 0.00 178.15 178.19 2o5j h LEU 1468N 0.27 0.00 0.16 1.44 4.07 -1.62 -3.46 115.31 116.17 2o5j h LEU 1468Ca 0.55 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.48 2o5j h LEU 1468Cb 1.09 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.82 2o5j h LEU 1468CO -0.60 0.10 -0.03 0.61 -1.08 0.00 0.00 178.44 177.43 2o5j n GLY 1469N 0.02 0.37 3.92 0.83 0.00 0.38 -5.03 105.19 105.68 2o5j n GLY 1469Ca 0.00 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.86 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 -3.45 3.57 0.55 1.61 3.52 -0.95 -5.04 118.95 118.76 2o5j s ARG 1470Ca 0.00 -0.09 -0.20 0.00 -0.13 0.00 0.00 55.73 55.31 2o5j s ARG 1470Cb 0.00 -2.62 -0.06 0.00 -1.56 0.00 0.00 34.95 30.71 2o5j s ARG 1470CO 0.00 0.14 0.97 -0.11 -0.81 0.00 0.00 175.30 175.49 2o5j n LEU 1471N -1.42 3.37 -4.71 -0.88 0.00 -1.26 -4.59 117.00 107.52 2o5j n LEU 1471Ca -0.03 0.87 -0.42 0.00 0.00 0.00 0.00 56.01 56.43 2o5j n LEU 1471Cb 0.55 -1.38 -0.03 0.00 0.00 0.00 0.00 43.42 42.56 2o5j n LEU 1471CO 0.49 -1.76 1.01 -0.63 0.00 0.00 0.00 177.39 176.50 2o5j s ILE 1472N -1.46 3.70 -1.06 1.96 -1.09 -1.26 -4.89 121.20 117.11 2o5j s ILE 1472Ca 0.72 1.19 0.04 0.00 -2.23 0.00 0.00 60.65 60.36 2o5j s ILE 1472Cb -0.45 -3.76 0.04 0.00 -1.58 0.00 0.00 42.46 36.71 2o5j s ILE 1472CO 0.50 0.06 1.10 -2.65 -1.23 0.00 0.00 174.94 172.72 2o5j n PRO 1473N 4.35 0.01 -4.33 2.79 -0.02 -1.26 -3.67 135.00 132.87 2o5j n PRO 1473Ca 0.11 0.41 -0.23 0.00 -2.02 0.00 0.00 63.50 61.77 2o5j n PRO 1473Cb 0.44 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.29 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 -2.94 1.59 0.00 3.55 0.00 -1.26 -4.22 121.76 118.47 2o5j s ALA 1474Ca 0.02 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.87 2o5j s ALA 1474Cb 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.92 2o5j s ALA 1474CO 0.07 0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.55 2o5j n GLY 1475N 1.35 1.00 0.09 0.00 0.00 -0.99 -4.18 105.19 102.45 2o5j n GLY 1475Ca -0.19 -1.05 0.11 0.00 0.00 0.00 0.00 46.02 44.89 2o5j n GLY 1475CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2o5j n THR 1476N 0.00 0.46 0.33 2.61 -1.04 -1.26 -3.05 114.28 112.33 2o5j n THR 1476Ca 0.00 -0.51 0.04 0.00 -2.04 0.00 0.00 64.05 61.54 2o5j n THR 1476Cb 0.00 -0.23 0.19 0.00 -1.82 0.00 0.00 70.33 68.47 2o5j n THR 1476CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2o5j n GLY 1477N 1.21 -0.72 3.61 3.41 0.00 -1.24 -3.23 105.19 108.23 2o5j n GLY 1477Ca -0.01 -0.03 -0.51 0.00 0.00 0.00 0.00 46.02 45.48 2o5j n GLY 1477CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2o5j n SER 1478N -1.43 2.81 0.11 1.61 2.88 -1.17 -4.60 113.62 113.83 2o5j n SER 1478Ca 0.03 0.76 0.16 0.00 -1.33 0.00 0.00 58.87 58.49 2o5j n SER 1478Cb 0.09 -1.30 0.70 0.00 -0.75 0.00 0.00 64.21 62.95 2o5j n SER 1478CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2o5j h ASP 1479N 10.26 0.00 -0.47 -3.46 3.45 -1.82 1.41 116.42 125.79 2o5j h ASP 1479Ca -0.41 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.04 2o5j h ASP 1479Cb 1.29 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 40.04 2o5j h ASP 1479CO 0.97 0.00 0.26 0.15 -1.57 0.00 0.00 179.24 179.05 2o5j h PHE 1480N 0.00 0.66 0.00 4.55 3.57 -1.92 -3.28 116.94 120.52 2o5j h PHE 1480Ca 0.15 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.65 2o5j h PHE 1480Cb 0.65 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.18 2o5j h PHE 1480CO 0.00 0.48 0.00 0.28 -2.23 0.00 0.00 178.31 176.84 2o5j n VAL 1481N -4.40 0.25 0.29 1.41 0.31 -0.31 -4.68 118.33 111.19 2o5j n VAL 1481Ca 0.04 -0.35 0.19 0.00 -0.01 0.00 0.00 64.34 64.21 2o5j n VAL 1481Cb 0.11 1.13 0.97 0.00 -0.91 0.00 0.00 33.84 35.13 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 -4.94 5.55 2.43 0.19 -3.36 114.38 114.25 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 0.54 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 29.73 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 -4.35 3.00 -0.30 2.20 0.40 -1.26 -5.05 117.98 112.63 2o5j s PHE 1483Ca -0.05 -1.98 -0.12 0.00 -0.60 0.00 0.00 56.93 54.18 2o5j s PHE 1483Cb 0.13 -1.91 0.13 0.00 0.51 0.00 0.00 43.02 41.88 2o5j s PHE 1483CO 0.44 -0.84 0.71 0.99 0.70 0.00 0.00 175.22 177.22 2o5j s THR 1484N 1.20 -0.75 0.23 0.64 2.01 -1.26 -5.03 115.64 112.68 2o5j s THR 1484Ca -0.02 0.00 0.07 0.00 0.31 0.00 0.00 61.69 62.05 2o5j s THR 1484Cb -0.17 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.31 2o5j s THR 1484CO -0.09 0.00 0.13 -1.10 -0.69 0.00 0.00 174.62 172.87 2o5j s GLN 1485N 2.61 2.74 0.12 4.92 -1.52 -1.26 -5.12 119.66 122.15 2o5j s GLN 1485Ca -0.06 -1.09 0.10 0.00 -1.95 0.00 0.00 55.36 52.36 2o5j s GLN 1485Cb -0.10 -2.48 -0.04 0.00 -0.22 0.00 0.00 33.01 30.17 2o5j s GLN 1485CO -0.19 0.42 -0.26 0.14 -0.25 0.00 0.00 175.29 175.15 2o5j s VAL 1486N -2.05 2.14 0.05 1.09 -7.23 -1.26 -5.14 120.40 108.01 2o5j s VAL 1486Ca 0.32 -1.69 -0.03 0.00 -1.81 0.00 0.00 61.98 58.76 2o5j s VAL 1486Cb -0.08 -1.90 -0.02 0.00 0.56 0.00 0.00 36.38 34.94 2o5j s VAL 1486CO 0.23 0.08 0.04 -0.69 -0.31 0.00 0.00 175.10 174.45 2o5j s VAL 1487N -1.06 0.18 -0.03 1.32 1.01 -1.26 -5.13 120.40 115.42 2o5j s VAL 1487Ca 0.12 -1.46 0.03 0.00 0.00 0.00 0.00 61.98 60.68 2o5j s VAL 1487Cb -0.10 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 2o5j s VAL 1487CO 0.05 -0.80 -0.10 1.51 0.00 0.00 0.00 175.10 175.76 2o5j s ASP 1488N -2.60 4.34 0.58 3.32 -4.77 -1.26 -5.00 116.67 111.28 2o5j s ASP 1488Ca 0.02 -0.15 0.29 0.00 -3.30 0.00 0.00 52.55 49.41 2o5j s ASP 1488Cb 0.04 -0.98 1.58 0.00 -1.09 0.00 0.00 42.92 42.47 2o5j s ASP 1488CO -0.08 0.33 1.87 1.56 0.70 0.00 0.00 175.17 179.55 2o5j h GLN 1489N 5.04 0.00 -0.21 2.11 1.08 -2.01 0.45 115.11 121.57 2o5j h GLN 1489Ca -0.48 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 56.52 2o5j h GLN 1489Cb 1.16 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.60 2o5j h GLN 1489CO 0.51 0.00 -0.67 0.87 -0.95 0.00 0.00 178.83 178.59 2o5j h LYS 1490N 0.00 0.81 0.00 1.46 1.57 -2.00 -2.87 116.57 115.53 2o5j h LYS 1490Ca 0.00 -0.59 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 2o5j h LYS 1490Cb 0.48 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.89 2o5j h LYS 1490CO 0.00 1.21 -0.34 2.41 -0.57 0.00 0.00 179.45 182.16 2o5j n THR 1491N -3.96 0.16 0.03 -0.16 -1.04 0.07 -3.05 114.28 106.33 2o5j n THR 1491Ca -0.06 -0.10 -0.20 0.00 -2.04 0.00 0.00 64.05 61.65 2o5j n THR 1491Cb 0.69 -0.14 -0.11 0.00 -1.82 0.00 0.00 70.33 68.96 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 0.83 -0.08 -4.42 7.12 -1.26 -2.54 115.31 114.95 2o5j h LEU 1492Ca 0.00 -0.74 -0.24 0.00 0.13 0.00 0.00 57.88 57.03 2o5j h LEU 1492Cb 0.59 -0.25 0.02 0.00 -0.53 0.00 0.00 40.66 40.48 2o5j h LEU 1492CO 0.00 1.46 -0.88 0.11 -0.13 0.00 0.00 178.44 179.01 2o5j h LYS 1493N 0.28 0.73 -0.55 1.25 1.79 -1.61 -3.04 116.57 115.43 2o5j h LYS 1493Ca -0.12 -0.68 0.06 0.00 -2.18 0.00 0.00 60.65 57.73 2o5j h LYS 1493Cb 1.61 0.17 -0.05 0.00 -1.58 0.00 0.00 32.23 32.37 2o5j h LYS 1493CO 0.19 1.28 0.25 0.00 -1.08 0.00 0.00 179.45 180.08 2o5j h ALA 1494N 0.47 0.71 -0.11 3.86 0.00 -1.58 -0.55 119.26 122.06 2o5j h ALA 1494Ca -0.09 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2o5j h ALA 1494Cb 1.52 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 2o5j h ALA 1494CO 0.18 -0.12 -0.31 0.82 0.00 0.00 0.00 179.25 179.81 2o5j h ILE 1495N 0.48 1.26 0.00 0.00 5.03 -1.53 -2.32 117.51 120.43 2o5j h ILE 1495Ca 0.26 -1.25 -0.07 0.00 -0.12 0.00 0.00 64.86 63.67 2o5j h ILE 1495Cb 0.22 1.53 -0.01 0.00 -3.03 0.00 0.00 36.82 35.53 2o5j h ILE 1495CO -0.21 0.37 -0.35 1.05 -0.68 0.00 0.00 178.15 178.33 2o5j h GLU 1496N 0.18 0.00 0.00 2.37 4.11 -1.20 -2.50 114.58 117.54 2o5j h GLU 1496Ca 0.02 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.40 2o5j h GLU 1496Cb 0.65 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 2o5j h GLU 1496CO 0.05 0.35 -0.25 0.93 0.07 0.00 0.00 179.01 180.16 2o5j h GLU 1497N 0.00 0.00 0.00 1.06 4.39 -0.59 -1.18 114.58 118.26 2o5j h GLU 1497Ca -0.00 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.50 2o5j h GLU 1497Cb 0.85 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.47 2o5j h GLU 1497CO 0.05 0.25 -0.91 0.00 -1.16 0.00 0.00 179.01 177.23 2o5j h ALA 1498N 1.75 0.50 0.02 3.43 0.00 -1.10 -2.71 119.26 121.15 2o5j h ALA 1498Ca -0.00 -0.81 -0.23 0.00 0.00 0.00 0.00 54.91 53.86 2o5j h ALA 1498Cb 0.88 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2o5j h ALA 1498CO 0.03 1.10 -1.12 0.00 0.00 0.00 0.00 179.25 179.26 2o5j h ARG 1499N 0.01 0.05 -0.11 0.00 3.08 -1.25 -3.27 114.38 112.89 2o5j h ARG 1499Ca -0.02 -0.09 -0.14 0.00 0.07 0.00 0.00 59.98 59.80 2o5j h ARG 1499Cb 1.60 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.67 2o5j h ARG 1499CO 0.12 0.99 -0.54 0.87 -1.07 0.00 0.00 179.97 180.34 2o5j h LYS 1500N 0.01 0.33 0.00 0.04 1.57 -1.25 -2.81 116.57 114.46 2o5j h LYS 1500Ca -0.06 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 2o5j h LYS 1500Cb 1.83 0.02 0.00 0.00 0.08 0.00 0.00 32.23 34.17 2o5j h LYS 1500CO 0.14 0.79 0.00 -1.91 -0.57 0.00 0.00 179.45 177.90 2o5j n GLU 1501N -3.93 0.01 0.26 3.15 0.00 -1.02 -3.11 120.64 116.00 2o5j n GLU 1501Ca -0.02 0.17 0.14 0.00 0.00 0.00 0.00 57.16 57.45 2o5j n GLU 1501Cb 0.58 -1.52 0.65 0.00 0.00 0.00 0.00 31.44 31.15 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 2.66 1.05 -1.71 4.31 0.00 -1.55 -3.42 119.26 120.61 2o5j h ALA 1502Ca 0.00 -0.09 -0.55 0.00 0.00 0.00 0.00 54.91 54.27 2o5j h ALA 1502Cb 0.35 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2o5j h ALA 1502CO 0.00 0.12 1.23 0.08 0.00 0.00 0.00 179.25 180.68 2o5j s VAL 1503N -3.78 3.58 0.19 0.00 1.01 -1.18 -4.97 120.40 115.24 2o5j s VAL 1503Ca -0.00 0.52 -0.30 0.00 0.00 0.00 0.00 61.98 62.20 2o5j s VAL 1503Cb 0.10 -3.95 -0.08 0.00 0.00 0.00 0.00 36.38 32.45 2o5j s VAL 1503CO 0.57 -0.73 1.12 -1.61 0.00 0.00 0.00 175.10 174.45 2o5j s GLU 1504N 5.86 4.58 0.00 2.72 0.41 -1.26 -5.13 118.70 125.87 2o5j s GLU 1504Ca 0.69 1.75 0.00 0.00 -0.41 0.00 0.00 54.97 57.00 2o5j s GLU 1504Cb -0.16 -3.26 0.00 0.00 -1.78 0.00 0.00 34.13 28.92 2o5j s GLU 1504CO 0.29 0.06 0.00 0.00 -0.49 0.00 0.00 175.26 175.12