#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1req s PRO 18 N 0.00 3.57 -0.02 -0.78 0.04 -1.26 -4.96 135.00 131.60 1req s PRO 18 Ca 0.00 1.89 0.03 0.00 0.04 0.00 0.00 61.00 62.96 1req s PRO 18 Cb 0.00 -2.35 0.05 0.00 0.04 0.00 0.00 34.50 32.24 1req s PRO 18 CO 0.00 -0.74 0.86 0.25 0.04 0.00 0.00 177.00 177.41 1req n THR 19 N -0.67 0.52 -0.76 1.26 -2.24 -1.26 -4.84 114.28 106.29 1req n THR 19 Ca 0.08 -0.59 0.08 0.00 -2.27 0.00 0.00 64.05 61.35 1req n THR 19 Cb 0.47 0.54 0.38 0.00 -2.10 0.00 0.00 70.33 69.63 1req n THR 19 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1req n THR 20 N -0.35 2.42 -2.52 4.28 -2.24 -1.26 -4.96 114.28 109.66 1req n THR 20 Ca 0.03 -1.30 -0.42 0.00 -2.27 0.00 0.00 64.05 60.08 1req n THR 20 Cb 0.54 -0.16 -0.03 0.00 -2.10 0.00 0.00 70.33 68.58 1req n THR 20 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1req s LEU 21 N -2.42 4.31 -0.17 3.22 2.96 -1.26 -4.99 118.68 120.33 1req s LEU 21 Ca 0.53 1.80 -0.08 0.00 -0.22 0.00 0.00 54.13 56.16 1req s LEU 21 Cb 0.38 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.46 1req s LEU 21 CO 0.18 -0.48 0.10 -0.55 -1.32 0.00 0.00 176.35 174.28 1req s SER 22 N 1.24 5.96 0.02 3.68 0.15 -1.26 -4.98 113.70 118.51 1req s SER 22 Ca 0.55 0.21 0.00 0.00 0.70 0.00 0.00 55.95 57.41 1req s SER 22 Cb -0.24 -2.00 0.00 0.00 -1.71 0.00 0.00 66.02 62.06 1req s SER 22 CO 0.24 0.23 0.00 0.18 1.20 0.00 0.00 173.24 175.09 1req n LEU 23 N 3.18 0.16 0.21 3.45 4.77 -1.26 -4.73 117.00 122.79 1req n LEU 23 Ca -0.17 0.02 0.13 0.00 -0.03 0.00 0.00 56.01 55.96 1req n LEU 23 Cb 0.53 -0.05 0.30 0.00 -2.33 0.00 0.00 43.42 41.87 1req n LEU 23 CO 0.35 -0.54 0.85 0.00 -1.33 0.00 0.00 177.39 176.72 1req h ALA 24 N 0.00 1.00 -1.02 -1.18 0.00 -1.96 -3.09 119.26 113.01 1req h ALA 24 Ca 0.00 0.00 0.29 0.00 0.00 0.00 0.00 54.91 55.20 1req h ALA 24 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.66 1req h ALA 24 CO 0.00 0.00 0.60 0.78 0.00 0.00 0.00 179.25 180.63 1req h GLY 25 N 3.67 1.89 1.34 0.00 0.00 -1.95 -2.23 103.07 105.79 1req h GLY 25 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1req h GLY 25 CO 0.00 -0.35 0.00 1.22 0.00 0.00 0.00 176.54 177.41 1req n ASP 26 N -4.92 0.00 -4.38 0.19 9.92 -1.17 -4.88 116.55 111.31 1req n ASP 26 Ca 0.29 -0.29 -0.20 0.00 -0.53 0.00 0.00 54.79 54.07 1req n ASP 26 Cb 0.89 -0.17 -0.10 0.00 -0.64 0.00 0.00 41.12 41.10 1req n ASP 26 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1req s PHE 27 N -2.34 1.85 0.22 1.24 0.08 -0.84 -5.11 117.98 113.08 1req s PHE 27 Ca 0.25 -0.52 -0.32 0.00 0.12 0.00 0.00 56.93 56.46 1req s PHE 27 Cb 0.15 -0.85 -0.14 0.00 -0.57 0.00 0.00 43.02 41.61 1req s PHE 27 CO 0.30 0.44 1.45 -2.30 -0.10 0.00 0.00 175.22 175.01 1req n PRO 28 N -0.44 2.05 -1.84 0.24 -0.02 -1.26 -4.82 135.00 128.90 1req n PRO 28 Ca -0.07 0.73 -0.42 0.00 -2.02 0.00 0.00 63.50 61.72 1req n PRO 28 Cb 0.60 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.64 1req n PRO 28 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1req s LYS 29 N -0.06 4.17 0.17 -0.52 0.00 -1.26 -4.95 119.74 117.29 1req s LYS 29 Ca 0.71 2.48 -0.30 0.00 0.00 0.00 0.00 55.97 58.86 1req s LYS 29 Cb -0.66 -3.10 -0.07 0.00 0.00 0.00 0.00 37.83 33.99 1req s LYS 29 CO 0.47 -0.65 0.93 0.00 0.00 0.00 0.00 175.35 176.10 1req s ALA 30 N 0.91 3.30 0.21 0.59 0.00 -1.26 -5.05 121.76 120.46 1req s ALA 30 Ca 0.70 0.57 0.07 0.00 0.00 0.00 0.00 51.96 53.30 1req s ALA 30 Cb -0.46 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.40 1req s ALA 30 CO 0.35 0.10 0.08 0.95 0.00 0.00 0.00 175.76 177.24 1req s THR 31 N -0.61 4.01 0.23 0.00 -4.23 -1.26 -5.05 115.64 108.74 1req s THR 31 Ca 0.43 -1.45 -0.06 0.00 -1.18 0.00 0.00 61.69 59.43 1req s THR 31 Cb -0.24 -3.09 0.21 0.00 1.34 0.00 0.00 72.50 70.71 1req s THR 31 CO 0.30 -0.23 1.70 -0.08 -0.54 0.00 0.00 174.62 175.78 1req h GLU 32 N 2.14 0.31 -1.00 3.99 4.57 -1.99 0.01 114.58 122.61 1req h GLU 32 Ca -0.47 -0.02 0.03 0.00 -1.18 0.00 0.00 59.36 57.72 1req h GLU 32 Cb 1.22 -0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 29.69 1req h GLU 32 CO 0.60 0.20 0.66 0.93 -1.18 0.00 0.00 179.01 180.22 1req h GLU 33 N 0.32 1.26 0.66 1.92 4.39 -1.97 0.21 114.58 121.36 1req h GLU 33 Ca 0.38 -0.08 -0.03 0.00 0.34 0.00 0.00 59.36 59.98 1req h GLU 33 Cb 0.61 -0.28 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1req h GLU 33 CO -0.44 0.83 -0.34 1.96 -1.16 0.00 0.00 179.01 179.86 1req h GLN 34 N 1.30 -0.89 -0.10 2.33 4.20 -1.43 -1.02 115.11 119.50 1req h GLN 34 Ca 0.38 0.06 0.03 0.00 0.06 0.00 0.00 58.65 59.19 1req h GLN 34 Cb -0.06 0.20 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 1req h GLN 34 CO -0.11 -0.59 -0.09 2.35 -0.67 0.00 0.00 178.83 179.72 1req h TRP 35 N -0.92 -0.22 -0.67 2.96 7.01 -0.98 -1.58 115.95 121.55 1req h TRP 35 Ca -0.09 0.01 0.14 0.00 2.11 0.00 0.00 58.89 61.07 1req h TRP 35 Cb 0.72 0.11 -0.11 0.00 -2.10 0.00 0.00 29.16 27.78 1req h TRP 35 CO -0.05 -0.14 0.03 0.93 -2.79 0.00 0.00 178.44 176.42 1req h GLU 36 N -0.11 0.13 -0.37 2.65 5.08 -0.68 0.35 114.58 121.64 1req h GLU 36 Ca 0.07 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1req h GLU 36 Cb 0.21 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1req h GLU 36 CO -0.17 0.09 0.10 0.00 -1.00 0.00 0.00 179.01 178.03 1req h ARG 37 N 0.14 0.54 -0.13 2.33 3.08 -0.72 -2.00 114.38 117.62 1req h ARG 37 Ca 0.36 -0.08 -0.17 0.00 0.07 0.00 0.00 59.98 60.15 1req h ARG 37 Cb 0.60 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 1req h ARG 37 CO -0.56 0.49 -0.64 0.93 -1.07 0.00 0.00 179.97 179.11 1req h GLU 38 N 0.53 0.48 -0.10 0.04 4.39 0.56 -2.29 114.58 118.19 1req h GLU 38 Ca 0.13 -0.35 0.01 0.00 0.34 0.00 0.00 59.36 59.49 1req h GLU 38 Cb 0.19 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 1req h GLU 38 CO -0.01 0.97 0.03 0.28 -1.16 0.00 0.00 179.01 179.12 1req h VAL 39 N 0.35 0.97 -0.95 3.13 2.07 -0.58 -2.93 116.25 118.31 1req h VAL 39 Ca -0.01 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1req h VAL 39 Cb 1.20 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.81 1req h VAL 39 CO 0.12 0.01 0.59 -0.33 0.02 0.00 0.00 177.57 177.98 1req h GLU 40 N 0.08 1.27 -0.78 1.57 5.08 -1.26 -2.49 114.58 118.05 1req h GLU 40 Ca 0.04 -0.10 0.06 0.00 -1.00 0.00 0.00 59.36 58.36 1req h GLU 40 Cb 0.03 -0.27 -0.06 0.00 0.50 0.00 0.00 28.75 28.95 1req h GLU 40 CO -0.05 0.87 0.47 0.87 -1.00 0.00 0.00 179.01 180.17 1req h LYS 41 N 1.30 0.84 -0.05 2.33 1.57 -1.28 0.17 116.57 121.45 1req h LYS 41 Ca 0.34 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 59.06 1req h LYS 41 Cb -0.09 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.03 1req h LYS 41 CO -0.07 0.55 -0.04 0.28 -0.57 0.00 0.00 179.45 179.61 1req h VAL 42 N 0.86 1.36 0.00 0.50 2.07 -1.30 -2.35 116.25 117.39 1req h VAL 42 Ca 0.34 -1.14 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 1req h VAL 42 Cb 0.16 2.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1req h VAL 42 CO -0.17 0.31 -0.15 -0.07 0.02 0.00 0.00 177.57 177.51 1req h LEU 43 N -0.33 0.00 -0.51 2.57 4.07 -1.31 -2.02 115.31 117.79 1req h LEU 43 Ca 0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1req h LEU 43 Cb 0.52 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.26 1req h LEU 43 CO 0.01 0.15 -0.07 0.59 -1.08 0.00 0.00 178.44 178.04 1req n ASN 44 N -3.45 0.86 -0.17 -0.43 3.02 0.60 -4.46 115.26 111.23 1req n ASN 44 Ca -0.01 -1.06 -0.10 0.00 -0.03 0.00 0.00 54.58 53.37 1req n ASN 44 Cb 0.32 -0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.43 1req n ASN 44 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1req h ARG 45 N 1.24 -0.29 0.00 3.52 3.08 -0.79 -2.27 114.38 118.88 1req h ARG 45 Ca 0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1req h ARG 45 Cb 0.36 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1req h ARG 45 CO 0.00 -0.19 0.00 0.78 -1.07 0.00 0.00 179.97 179.49 1req h GLY 46 N -0.30 0.00 -4.30 0.04 0.00 -1.83 -3.47 103.07 93.21 1req h GLY 46 Ca 0.14 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.94 1req h GLY 46 CO -0.64 0.00 0.71 0.50 0.00 0.00 0.00 176.54 177.12 1req s ARG 47 N -3.12 4.32 0.92 4.80 0.52 -0.86 -5.03 118.95 120.51 1req s ARG 47 Ca 0.10 2.17 -0.11 0.00 -0.52 0.00 0.00 55.73 57.37 1req s ARG 47 Cb 0.11 -3.17 0.15 0.00 0.52 0.00 0.00 34.95 32.57 1req s ARG 47 CO 0.59 -0.36 1.11 -1.25 0.02 0.00 0.00 175.30 175.42 1req s PRO 48 N 0.01 0.98 0.18 3.54 0.04 -1.26 -4.93 135.00 133.55 1req s PRO 48 Ca 0.59 1.31 -0.21 0.00 0.04 0.00 0.00 61.00 62.73 1req s PRO 48 Cb -0.39 -1.74 0.10 0.00 0.04 0.00 0.00 34.50 32.51 1req s PRO 48 CO 0.39 -2.58 1.59 -1.35 0.04 0.00 0.00 177.00 175.09 1req h PRO 49 N -1.82 -0.19 -0.10 0.56 0.11 -1.99 -2.66 132.00 125.91 1req h PRO 49 Ca -0.46 0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.67 1req h PRO 49 Cb 1.27 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.40 1req h PRO 49 CO 0.46 -0.13 -0.19 0.93 -0.21 0.00 0.00 178.00 178.86 1req h GLU 50 N -0.20 -0.16 -3.85 1.05 3.07 -2.05 -3.37 114.58 109.08 1req h GLU 50 Ca 0.21 0.01 -0.66 0.00 -0.50 0.00 0.00 59.36 58.42 1req h GLU 50 Cb 0.54 0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.48 1req h GLU 50 CO -0.61 -0.10 3.06 1.63 -1.40 0.00 0.00 179.01 181.59 1req n LYS 51 N -3.58 2.67 -4.02 2.33 5.02 -1.00 -4.97 118.16 114.60 1req n LYS 51 Ca -0.02 -2.26 -0.36 0.00 -2.02 0.00 0.00 58.31 53.66 1req n LYS 51 Cb 0.12 -3.04 -0.08 0.00 -0.02 0.00 0.00 35.03 32.01 1req n LYS 51 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1req s GLN 52 N 3.38 3.56 0.04 1.97 -1.52 -1.26 -4.58 119.66 121.25 1req s GLN 52 Ca 0.53 -0.27 -0.15 0.00 -1.95 0.00 0.00 55.36 53.52 1req s GLN 52 Cb 0.15 -3.12 -0.06 0.00 -0.22 0.00 0.00 33.01 29.75 1req s GLN 52 CO -0.04 0.57 0.46 -0.51 -0.25 0.00 0.00 175.29 175.53 1req s LEU 53 N -0.46 4.46 0.72 2.90 1.43 -1.26 -5.07 118.68 121.40 1req s LEU 53 Ca 0.10 1.04 -0.04 0.00 -1.03 0.00 0.00 54.13 54.21 1req s LEU 53 Cb -0.12 -2.77 0.10 0.00 0.03 0.00 0.00 46.19 43.44 1req s LEU 53 CO 0.02 0.28 1.00 0.42 0.23 0.00 0.00 176.35 178.30 1req s THR 54 N -1.16 2.25 0.08 5.49 -4.23 -1.26 -4.88 115.64 111.93 1req s THR 54 Ca 0.27 -0.46 -0.30 0.00 -1.18 0.00 0.00 61.69 60.02 1req s THR 54 Cb -0.17 -2.79 -0.15 0.00 1.34 0.00 0.00 72.50 70.73 1req s THR 54 CO 0.16 0.00 1.64 0.15 -0.54 0.00 0.00 174.62 176.03 1req h PHE 55 N -0.58 -0.71 -0.71 3.99 3.57 -1.98 -0.31 116.94 120.21 1req h PHE 55 Ca -0.40 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.25 1req h PHE 55 Cb 1.28 0.26 -0.11 0.00 2.79 0.00 0.00 35.95 40.16 1req h PHE 55 CO -0.10 -0.42 0.10 0.00 -2.23 0.00 0.00 178.31 175.67 1req h ALA 56 N -0.14 0.84 -0.82 2.41 0.00 -1.98 0.38 119.26 119.94 1req h ALA 56 Ca -0.05 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1req h ALA 56 Cb 0.56 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 1req h ALA 56 CO 0.04 -0.37 0.46 0.93 0.00 0.00 0.00 179.25 180.31 1req h GLU 57 N 0.20 1.14 -0.65 0.00 5.08 -1.80 -2.41 114.58 116.14 1req h GLU 57 Ca 0.39 -0.12 -0.09 0.00 -1.00 0.00 0.00 59.36 58.54 1req h GLU 57 Cb 0.67 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1req h GLU 57 CO -0.55 0.82 0.07 0.00 -1.00 0.00 0.00 179.01 178.36 1req h LEU 59 N 1.02 1.07 -0.37 0.00 5.85 -0.19 -0.11 115.31 122.59 1req h LEU 59 Ca 0.19 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1req h LEU 59 Cb 0.49 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1req h LEU 59 CO 0.02 0.93 -0.00 0.50 -0.34 0.00 0.00 178.44 179.55 1req h LYS 60 N 1.14 0.65 0.00 1.25 3.64 -1.43 -2.35 116.57 119.47 1req h LYS 60 Ca 0.27 -0.21 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1req h LYS 60 Cb 0.18 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1req h LYS 60 CO -0.03 0.76 -0.11 0.00 -2.27 0.00 0.00 179.45 177.80 1req h ARG 61 N 0.47 0.00 -0.05 1.90 3.08 -1.08 -2.78 114.38 115.92 1req h ARG 61 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1req h ARG 61 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1req h ARG 61 CO 0.02 0.11 0.00 1.28 -1.07 0.00 0.00 179.97 180.31 1req n LEU 62 N -3.77 1.25 -4.81 3.04 4.77 -0.11 -4.87 117.00 112.50 1req n LEU 62 Ca -0.02 -0.46 -0.38 0.00 -0.03 0.00 0.00 56.01 55.12 1req n LEU 62 Cb 0.22 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.22 1req n LEU 62 CO 0.31 0.23 0.17 -0.89 -1.33 0.00 0.00 177.39 175.87 1req s THR 63 N -1.94 4.96 -0.10 -5.08 2.01 -0.90 -4.15 115.64 110.44 1req s THR 63 Ca 0.37 0.98 -0.01 0.00 0.31 0.00 0.00 61.69 63.34 1req s THR 63 Cb 0.20 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.89 1req s THR 63 CO 0.31 0.53 -0.04 -0.69 -0.69 0.00 0.00 174.62 174.04 1req s VAL 64 N -0.78 3.93 -0.22 3.82 1.01 0.80 -4.91 120.40 124.04 1req s VAL 64 Ca 0.26 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.83 1req s VAL 64 Cb -0.17 -2.66 -0.00 0.00 0.00 0.00 0.00 36.38 33.55 1req s VAL 64 CO 0.15 0.56 -0.06 -1.00 0.00 0.00 0.00 175.10 174.75 1req s HIS 65 N -0.42 2.94 1.00 5.22 3.76 -1.26 0.02 115.29 126.56 1req s HIS 65 Ca 0.07 -1.09 -0.15 0.00 -0.15 0.00 0.00 55.06 53.74 1req s HIS 65 Cb -0.12 -2.08 0.19 0.00 1.11 0.00 0.00 32.58 31.68 1req s HIS 65 CO 0.02 -0.60 1.16 0.95 -0.85 0.00 0.00 174.74 175.42 1req s THR 66 N 1.44 1.90 0.18 1.30 -4.23 -0.36 -4.91 115.64 110.95 1req s THR 66 Ca 0.05 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 60.44 1req s THR 66 Cb -0.14 -2.70 0.09 0.00 1.34 0.00 0.00 72.50 71.09 1req s THR 66 CO -0.05 0.00 1.76 0.58 -0.54 0.00 0.00 174.62 176.38 1req h VAL 67 N -1.84 1.22 -0.54 2.29 2.07 -1.98 -3.03 116.25 114.44 1req h VAL 67 Ca -0.49 -0.61 -0.36 0.00 0.82 0.00 0.00 66.70 66.07 1req h VAL 67 Cb 1.31 0.48 -0.16 0.00 -1.52 0.00 0.00 31.29 31.40 1req h VAL 67 CO 0.51 0.25 0.46 -0.90 0.02 0.00 0.00 177.57 177.90 1req n ASP 68 N -4.51 6.25 -1.71 0.57 5.68 -1.26 -4.93 116.55 116.65 1req n ASP 68 Ca 0.04 -3.12 -0.16 0.00 -0.50 0.00 0.00 54.79 51.05 1req n ASP 68 Cb 0.13 -1.01 -0.02 0.00 -1.14 0.00 0.00 41.12 39.08 1req n ASP 68 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1req n GLY 69 N 0.13 0.20 3.68 6.12 0.00 -1.15 -4.93 105.19 109.24 1req n GLY 69 Ca 0.34 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 1req n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1req s ILE 70 N -2.76 5.14 -0.13 -0.61 -1.09 -1.26 -4.87 121.20 115.62 1req s ILE 70 Ca 0.00 0.94 -0.18 0.00 -2.23 0.00 0.00 60.65 59.18 1req s ILE 70 Cb 0.00 -3.83 -0.04 0.00 -1.58 0.00 0.00 42.46 37.01 1req s ILE 70 CO 0.00 0.24 0.47 -1.81 -1.23 0.00 0.00 174.94 172.61 1req s ASP 71 N 0.95 6.66 -0.20 3.58 1.11 -1.26 -1.23 116.67 126.28 1req s ASP 71 Ca 0.24 0.78 0.01 0.00 0.18 0.00 0.00 52.55 53.77 1req s ASP 71 Cb -0.15 -2.28 0.04 0.00 1.07 0.00 0.00 42.92 41.59 1req s ASP 71 CO 0.10 -0.02 -0.15 -0.63 1.18 0.00 0.00 175.17 175.65 1req s ILE 72 N 0.75 1.92 0.46 0.77 1.01 0.10 -4.97 121.20 121.25 1req s ILE 72 Ca 0.25 -1.09 -0.00 0.00 0.00 0.00 0.00 60.65 59.81 1req s ILE 72 Cb -0.15 -1.88 -0.00 0.00 0.01 0.00 0.00 42.46 40.44 1req s ILE 72 CO 0.10 0.30 0.69 0.68 0.00 0.00 0.00 174.94 176.71 1req s VAL 73 N 1.29 4.01 -0.06 2.92 -7.23 -1.26 -0.14 120.40 119.92 1req s VAL 73 Ca 0.00 -0.44 0.16 0.00 -1.81 0.00 0.00 61.98 59.89 1req s VAL 73 Cb -0.15 -3.49 0.07 0.00 0.56 0.00 0.00 36.38 33.36 1req s VAL 73 CO -0.10 -0.36 1.51 1.55 -0.31 0.00 0.00 175.10 177.39 1req h PRO 74 N 0.35 0.00 -3.68 4.82 0.13 -1.91 -3.44 132.00 128.26 1req h PRO 74 Ca -0.46 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.42 1req h PRO 74 Cb 1.25 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.09 1req h PRO 74 CO 0.58 0.49 -0.72 1.41 -0.23 0.00 0.00 178.00 179.53 1req s MET 75 N -3.10 -0.01 0.01 0.86 1.75 -1.26 -5.15 119.30 112.40 1req s MET 75 Ca 0.03 0.04 0.06 0.00 -1.25 0.00 0.00 55.69 54.57 1req s MET 75 Cb 0.08 -0.06 -0.03 0.00 2.84 0.00 0.00 34.83 37.67 1req s MET 75 CO 0.73 -0.04 -0.16 0.71 -0.65 0.00 0.00 175.02 175.62 1req s TYR 76 N 0.25 2.63 0.39 4.11 1.51 -1.26 -5.07 117.35 119.90 1req s TYR 76 Ca -0.02 -0.21 0.08 0.00 -1.01 0.00 0.00 57.07 55.91 1req s TYR 76 Cb -0.03 -1.53 -0.07 0.00 -0.11 0.00 0.00 41.96 40.22 1req s TYR 76 CO -0.01 0.24 0.01 1.03 -1.11 0.00 0.00 175.55 175.72 1req s ARG 77 N -1.22 1.98 0.36 -0.62 0.52 -1.26 -4.84 118.95 113.87 1req s ARG 77 Ca 0.14 -2.01 0.07 0.00 -0.52 0.00 0.00 55.73 53.40 1req s ARG 77 Cb -0.11 -1.72 0.76 0.00 0.52 0.00 0.00 34.95 34.40 1req s ARG 77 CO 0.04 -0.01 1.94 -1.35 0.02 0.00 0.00 175.30 175.94 1req h PRO 78 N 1.77 0.72 -0.94 3.54 0.11 -1.98 -2.32 132.00 132.90 1req h PRO 78 Ca -0.43 -0.04 0.23 0.00 0.11 0.00 0.00 66.00 65.86 1req h PRO 78 Cb 1.24 -0.16 -0.07 0.00 0.11 0.00 0.00 31.00 32.12 1req h PRO 78 CO 0.76 0.48 0.63 1.57 -0.21 0.00 0.00 178.00 181.23 1req h LYS 79 N 0.74 0.33 0.00 1.05 2.10 -1.99 -2.54 116.57 116.26 1req h LYS 79 Ca 0.35 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.98 1req h LYS 79 Cb 0.38 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.63 1req h LYS 79 CO -0.13 0.22 0.00 -0.25 -2.00 0.00 0.00 179.45 177.29 1req n ASP 80 N -4.49 0.00 -4.62 7.07 8.00 -0.87 -4.78 116.55 116.86 1req n ASP 80 Ca 0.21 -0.19 -0.27 0.00 0.71 0.00 0.00 54.79 55.25 1req n ASP 80 Cb 0.79 -0.20 -0.09 0.00 -0.02 0.00 0.00 41.12 41.61 1req n ASP 80 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1req s ALA 81 N -2.39 3.07 0.54 2.24 0.00 -0.96 -3.37 121.76 120.89 1req s ALA 81 Ca 0.22 -1.40 -0.21 0.00 0.00 0.00 0.00 51.96 50.57 1req s ALA 81 Cb 0.13 -0.87 -0.06 0.00 0.00 0.00 0.00 23.12 22.32 1req s ALA 81 CO 0.27 0.49 1.12 -0.35 0.00 0.00 0.00 175.76 177.29 1req n PRO 82 N 0.02 1.30 0.03 0.00 -0.04 -1.26 -4.88 135.00 130.17 1req n PRO 82 Ca -0.10 0.48 -0.08 0.00 -0.04 0.00 0.00 63.50 63.76 1req n PRO 82 Cb 0.55 -2.29 0.09 0.00 -0.04 0.00 0.00 33.50 31.81 1req n PRO 82 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1req h LYS 83 N 1.08 0.46 -4.77 0.54 1.63 -1.94 -3.40 116.57 110.17 1req h LYS 83 Ca -0.48 -0.28 -0.67 0.00 -0.85 0.00 0.00 60.65 58.36 1req h LYS 83 Cb 1.34 0.03 -0.21 0.00 -0.60 0.00 0.00 32.23 32.79 1req h LYS 83 CO 0.54 0.88 -0.53 -1.59 -3.45 0.00 0.00 179.45 175.30 1req s LYS 84 N -3.98 3.46 0.19 1.90 0.00 -1.26 -4.99 119.74 115.05 1req s LYS 84 Ca -0.06 -0.65 0.12 0.00 0.00 0.00 0.00 55.97 55.38 1req s LYS 84 Cb 0.12 -3.65 -0.07 0.00 0.00 0.00 0.00 37.83 34.23 1req s LYS 84 CO 0.82 -0.40 1.31 -0.07 0.00 0.00 0.00 175.35 177.02 1req h LEU 85 N 8.40 0.00 0.00 2.77 3.38 -2.00 -3.51 115.31 124.35 1req h LEU 85 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1req h LEU 85 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1req h LEU 85 CO 0.61 0.72 0.00 0.61 0.09 0.00 0.00 178.44 180.47 1req n GLY 86 N 1.30 -0.50 3.09 0.83 0.00 -1.26 -4.88 105.19 103.78 1req n GLY 86 Ca -0.00 -1.74 -0.18 0.00 0.00 0.00 0.00 46.02 44.09 1req n GLY 86 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1req s TYR 87 N -1.72 0.99 0.31 1.61 1.51 -1.26 -5.04 117.35 113.75 1req s TYR 87 Ca 0.00 -0.33 -0.27 0.00 -1.01 0.00 0.00 57.07 55.46 1req s TYR 87 Cb 0.00 -0.59 -0.09 0.00 -0.11 0.00 0.00 41.96 41.16 1req s TYR 87 CO 0.00 0.00 1.02 -1.25 -1.11 0.00 0.00 175.55 174.21 1req s PRO 88 N -1.00 4.55 0.00 -1.71 0.04 -1.26 -3.91 135.00 131.72 1req s PRO 88 Ca -0.00 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.60 1req s PRO 88 Cb -0.07 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.51 1req s PRO 88 CO 0.01 0.20 0.00 0.41 0.04 0.00 0.00 177.00 177.66 1req n GLY 89 N 0.90 0.46 3.56 0.56 0.00 -0.87 -4.80 105.19 105.00 1req n GLY 89 Ca 0.01 -0.65 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 1req n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1req s VAL 90 N -2.00 -0.00 0.43 1.61 1.01 -1.25 -4.91 120.40 115.29 1req s VAL 90 Ca 0.00 0.01 -0.23 0.00 0.00 0.00 0.00 61.98 61.76 1req s VAL 90 Cb 0.00 -0.91 -0.11 0.00 0.00 0.00 0.00 36.38 35.36 1req s VAL 90 CO 0.00 0.00 0.78 0.00 0.00 0.00 0.00 175.10 175.89 1req n ALA 91 N 3.25 -0.65 1.49 5.51 0.00 -1.26 -2.17 120.51 126.69 1req n ALA 91 Ca -0.16 0.19 0.12 0.00 0.00 0.00 0.00 53.44 53.59 1req n ALA 91 Cb 0.56 -1.93 0.72 0.00 0.00 0.00 0.00 19.45 18.80 1req n ALA 91 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1req n PRO 92 N 0.29 0.70 -0.65 0.00 -0.04 -1.26 -4.79 135.00 129.26 1req n PRO 92 Ca 0.11 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1req n PRO 92 Cb 0.39 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 1req n PRO 92 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1req n PHE 93 N -1.05 0.00 -0.23 0.54 3.72 -0.92 -4.13 117.46 115.38 1req n PHE 93 Ca 0.17 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.61 1req n PHE 93 Cb 0.11 -0.04 0.14 0.00 -0.94 0.00 0.00 39.48 38.75 1req n PHE 93 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1req h THR 94 N 0.00 0.51 0.00 4.37 2.02 -1.84 -0.38 112.91 117.58 1req h THR 94 Ca 0.00 -0.07 -0.05 0.00 0.77 0.00 0.00 66.41 67.06 1req h THR 94 Cb 0.00 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 1req h THR 94 CO 0.00 0.04 -0.22 0.03 0.37 0.00 0.00 175.52 175.74 1req h ARG 95 N 0.20 0.00 0.00 6.66 3.08 -1.89 -3.42 114.38 119.02 1req h ARG 95 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 1req h ARG 95 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1req h ARG 95 CO -0.51 0.22 0.00 0.41 -1.07 0.00 0.00 179.97 179.02 1req n GLY 96 N -0.83 2.65 0.34 0.04 0.00 -0.15 -4.35 105.19 102.87 1req n GLY 96 Ca -0.02 -0.89 -0.17 0.00 0.00 0.00 0.00 46.02 44.94 1req n GLY 96 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1req n THR 97 N -0.87 1.27 -3.38 2.61 -1.04 -1.26 -2.06 114.28 109.55 1req n THR 97 Ca 0.00 -0.11 -0.38 0.00 -2.04 0.00 0.00 64.05 61.52 1req n THR 97 Cb 0.00 -1.93 -0.06 0.00 -1.82 0.00 0.00 70.33 66.52 1req n THR 97 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1req s THR 98 N -2.50 5.10 -0.01 12.58 2.01 -1.26 -3.31 115.64 128.25 1req s THR 98 Ca -0.27 0.92 -0.29 0.00 0.31 0.00 0.00 61.69 62.36 1req s THR 98 Cb 0.08 -3.78 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 1req s THR 98 CO 0.36 0.43 0.96 -0.69 -0.69 0.00 0.00 174.62 174.99 1req s VAL 99 N -0.10 4.88 0.10 3.82 1.01 -1.26 -4.82 120.40 124.03 1req s VAL 99 Ca 0.25 2.01 -0.16 0.00 0.00 0.00 0.00 61.98 64.09 1req s VAL 99 Cb -0.16 -4.30 -0.07 0.00 0.00 0.00 0.00 36.38 31.86 1req s VAL 99 CO 0.12 0.17 0.52 -0.13 0.00 0.00 0.00 175.10 175.78 1req s ARG 100 N 1.00 4.03 -0.02 2.72 0.52 -1.26 -5.01 118.95 120.93 1req s ARG 100 Ca 0.51 0.54 0.15 0.00 -0.52 0.00 0.00 55.73 56.41 1req s ARG 100 Cb -0.21 -3.08 0.47 0.00 0.52 0.00 0.00 34.95 32.65 1req s ARG 100 CO 0.27 0.57 1.38 0.27 0.02 0.00 0.00 175.30 177.81 1req n ASN 101 N 1.27 2.96 0.00 0.23 6.94 -1.26 -4.84 115.26 120.55 1req n ASN 101 Ca -0.08 -2.08 0.00 0.00 -0.02 0.00 0.00 54.58 52.40 1req n ASN 101 Cb 0.52 -0.38 0.00 0.00 -2.36 0.00 0.00 39.78 37.55 1req n ASN 101 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1req n GLY 102 N 1.22 0.73 3.91 4.83 0.00 -1.26 -5.06 105.19 109.56 1req n GLY 102 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 1req n GLY 102 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1req s ASP 103 N -2.43 5.99 0.07 1.61 1.11 -1.26 -4.76 116.67 117.00 1req s ASP 103 Ca 0.00 0.87 -0.18 0.00 0.18 0.00 0.00 52.55 53.43 1req s ASP 103 Cb 0.00 -2.04 -0.11 0.00 1.07 0.00 0.00 42.92 41.84 1req s ASP 103 CO 0.00 -0.80 1.39 0.00 1.18 0.00 0.00 175.17 176.95 1req h MET 104 N 0.02 0.53 -5.49 8.23 -0.00 -1.90 -3.36 114.93 112.97 1req h MET 104 Ca -0.46 -0.27 -0.63 0.00 -0.00 0.00 0.00 59.70 58.34 1req h MET 104 Cb 1.22 0.01 -0.14 0.00 -0.00 0.00 0.00 31.60 32.69 1req h MET 104 CO 0.61 0.85 0.70 -0.51 -0.00 0.00 0.00 176.91 178.56 1req s ASP 105 N -6.31 6.28 -0.23 -0.10 1.01 -1.26 -4.62 116.67 111.43 1req s ASP 105 Ca -0.13 -1.17 0.09 0.00 0.71 0.00 0.00 52.55 52.05 1req s ASP 105 Cb 0.07 -2.44 -0.21 0.00 1.01 0.00 0.00 42.92 41.36 1req s ASP 105 CO 0.79 -1.41 -0.10 0.00 0.21 0.00 0.00 175.17 174.66 1req n ALA 106 N 7.71 1.46 -2.16 5.23 0.00 -1.26 -4.98 120.51 126.52 1req n ALA 106 Ca 0.04 -1.21 -0.20 0.00 0.00 0.00 0.00 53.44 52.08 1req n ALA 106 Cb 0.47 -0.14 -0.02 0.00 0.00 0.00 0.00 19.45 19.76 1req n ALA 106 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 1req s TRP 107 N -2.51 2.72 -0.32 0.00 -2.14 -1.26 -5.00 118.94 110.43 1req s TRP 107 Ca -0.24 -0.47 -0.21 0.00 2.66 0.00 0.00 56.10 57.84 1req s TRP 107 Cb 0.08 -2.23 -0.00 0.00 -3.10 0.00 0.00 33.47 28.21 1req s TRP 107 CO 0.70 -0.21 0.64 0.34 -2.66 0.00 0.00 176.95 175.76 1req s ASP 108 N -4.19 6.49 -0.44 -2.66 -1.08 -0.98 -4.97 116.67 108.83 1req s ASP 108 Ca 0.50 0.36 -0.27 0.00 -0.52 0.00 0.00 52.55 52.63 1req s ASP 108 Cb -0.05 -2.34 0.03 0.00 -1.46 0.00 0.00 42.92 39.10 1req s ASP 108 CO 0.29 -0.52 0.99 -0.69 0.52 0.00 0.00 175.17 175.76 1req s VAL 109 N 2.67 4.43 -0.41 1.11 1.01 -1.26 -1.00 120.40 126.94 1req s VAL 109 Ca 0.26 1.00 -0.06 0.00 0.00 0.00 0.00 61.98 63.18 1req s VAL 109 Cb -0.15 -4.46 0.09 0.00 0.00 0.00 0.00 36.38 31.87 1req s VAL 109 CO 0.13 -0.81 0.21 -0.60 0.00 0.00 0.00 175.10 174.03 1req s ARG 110 N 3.88 2.31 0.14 2.72 3.52 -0.84 0.33 118.95 131.00 1req s ARG 110 Ca 0.40 -1.63 -0.30 0.00 -0.13 0.00 0.00 55.73 54.07 1req s ARG 110 Cb -0.10 -3.64 -0.07 0.00 -1.56 0.00 0.00 34.95 29.58 1req s ARG 110 CO 0.26 -0.99 1.20 0.00 -0.81 0.00 0.00 175.30 174.96 1req s ALA 111 N 1.27 3.43 -0.17 6.12 0.00 -1.04 -4.12 121.76 127.25 1req s ALA 111 Ca 0.04 0.92 -0.23 0.00 0.00 0.00 0.00 51.96 52.69 1req s ALA 111 Cb -0.23 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.44 1req s ALA 111 CO -0.01 -0.40 0.72 -1.17 0.00 0.00 0.00 175.76 174.90 1req s LEU 112 N 0.31 4.18 -0.13 0.00 2.96 -1.26 -1.68 118.68 123.06 1req s LEU 112 Ca 0.55 1.02 0.01 0.00 -0.22 0.00 0.00 54.13 55.50 1req s LEU 112 Cb -0.32 -3.06 0.02 0.00 0.50 0.00 0.00 46.19 43.33 1req s LEU 112 CO 0.33 -0.31 -0.15 -1.00 -1.32 0.00 0.00 176.35 173.91 1req s HIS 113 N 1.88 2.06 0.00 5.38 3.76 0.01 -4.97 115.29 123.41 1req s HIS 113 Ca 0.34 -1.05 0.00 0.00 -0.15 0.00 0.00 55.06 54.20 1req s HIS 113 Cb -0.16 -1.50 0.00 0.00 1.11 0.00 0.00 32.58 32.03 1req s HIS 113 CO 0.12 -0.56 0.05 0.39 -0.85 0.00 0.00 174.74 173.90 1req n GLU 114 N 4.43 -0.04 -2.63 1.40 1.02 -1.26 -1.57 120.64 121.99 1req n GLU 114 Ca -0.18 -0.06 -0.43 0.00 -0.02 0.00 0.00 57.16 56.48 1req n GLU 114 Cb 0.51 -0.53 -0.02 0.00 -0.02 0.00 0.00 31.44 31.38 1req n GLU 114 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1req s ASP 115 N -0.00 7.13 0.18 1.62 -1.08 -1.26 -4.25 116.67 119.00 1req s ASP 115 Ca 0.00 1.49 -0.13 0.00 -0.52 0.00 0.00 52.55 53.39 1req s ASP 115 Cb 0.00 -2.55 0.15 0.00 -1.46 0.00 0.00 42.92 39.06 1req s ASP 115 CO 0.00 -0.60 1.77 -0.65 0.52 0.00 0.00 175.17 176.21 1req h PRO 116 N 7.41 0.41 -6.15 4.34 0.11 -1.89 -3.41 132.00 132.80 1req h PRO 116 Ca -0.25 -0.02 -0.70 0.00 0.11 0.00 0.00 66.00 65.14 1req h PRO 116 Cb 1.10 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 32.13 1req h PRO 116 CO 0.93 0.27 1.03 -3.47 -0.21 0.00 0.00 178.00 176.54 1req n ASP 117 N -4.95 2.60 0.18 -2.05 -0.08 -1.26 -4.76 116.55 106.23 1req n ASP 117 Ca 0.05 0.96 0.07 0.00 -1.51 0.00 0.00 54.79 54.36 1req n ASP 117 Cb 0.17 -1.21 0.10 0.00 2.34 0.00 0.00 41.12 42.51 1req n ASP 117 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 1req h GLU 118 N 8.41 0.00 0.04 -0.67 -0.00 -1.99 -2.22 114.58 118.15 1req h GLU 118 Ca -0.44 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 58.92 1req h GLU 118 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.06 1req h GLU 118 CO 0.97 0.23 -0.02 1.57 -0.00 0.00 0.00 179.01 181.77 1req h LYS 119 N 0.00 -0.05 0.07 1.06 -0.00 -1.96 -2.91 116.57 112.79 1req h LYS 119 Ca -0.00 0.00 0.02 0.00 -0.00 0.00 0.00 60.65 60.67 1req h LYS 119 Cb 1.18 0.01 -0.05 0.00 -0.00 0.00 0.00 32.23 33.38 1req h LYS 119 CO 0.03 0.39 -0.41 0.35 -0.00 0.00 0.00 179.45 179.82 1req h PHE 120 N -0.50 -1.14 -0.92 0.07 3.57 -1.92 -2.34 116.94 113.75 1req h PHE 120 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1req h PHE 120 Cb 0.46 0.49 -0.05 0.00 2.79 0.00 0.00 35.95 39.65 1req h PHE 120 CO 0.08 -0.50 0.59 1.15 -2.23 0.00 0.00 178.31 177.40 1req h THR 121 N -0.61 1.24 0.45 4.41 2.02 -1.51 -0.26 112.91 118.65 1req h THR 121 Ca 0.03 -0.47 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 1req h THR 121 Cb 0.66 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1req h THR 121 CO -0.27 0.24 -0.35 -0.09 0.37 0.00 0.00 175.52 175.42 1req h ARG 122 N 1.26 -0.76 -0.03 6.66 2.43 -1.38 0.21 114.38 122.75 1req h ARG 122 Ca 0.34 0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.59 1req h ARG 122 Cb -0.12 0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 29.55 1req h ARG 122 CO -0.07 -0.51 -0.33 0.87 -1.51 0.00 0.00 179.97 178.42 1req h LYS 123 N -0.79 -0.45 -0.65 0.20 1.57 -1.19 -1.71 116.57 113.55 1req h LYS 123 Ca -0.04 0.03 0.12 0.00 -1.87 0.00 0.00 60.65 58.89 1req h LYS 123 Cb 0.68 0.10 -0.09 0.00 0.08 0.00 0.00 32.23 33.01 1req h LYS 123 CO -0.01 -0.30 0.19 0.00 -0.57 0.00 0.00 179.45 178.76 1req h ALA 124 N 0.26 0.82 -0.02 3.86 0.00 -0.98 0.15 119.26 123.35 1req h ALA 124 Ca 0.07 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.11 1req h ALA 124 Cb 0.57 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1req h ALA 124 CO -0.29 -0.27 -0.05 0.82 0.00 0.00 0.00 179.25 179.46 1req h ILE 125 N 0.33 0.86 0.55 0.00 2.04 -0.41 -2.50 117.51 118.38 1req h ILE 125 Ca 0.34 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.18 1req h ILE 125 Cb 0.51 0.86 0.01 0.00 -0.74 0.00 0.00 36.82 37.46 1req h ILE 125 CO -0.39 0.00 -0.27 0.25 0.00 0.00 0.00 178.15 177.74 1req h LEU 126 N -0.08 -0.63 -0.31 1.44 5.85 0.12 -0.37 115.31 121.33 1req h LEU 126 Ca 0.03 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.76 1req h LEU 126 Cb 0.12 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 1req h LEU 126 CO -0.07 -0.39 -0.18 -0.62 -0.34 0.00 0.00 178.44 176.85 1req n GLU 127 N -5.38 -0.14 -0.24 1.25 1.02 0.17 -0.47 120.64 116.86 1req n GLU 127 Ca -0.12 0.88 0.03 0.00 -0.02 0.00 0.00 57.16 57.93 1req n GLU 127 Cb 0.32 -1.31 0.15 0.00 -0.02 0.00 0.00 31.44 30.59 1req n GLU 127 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1req h GLY 128 N 0.00 1.05 2.00 0.62 0.00 -1.44 -2.56 103.07 102.74 1req h GLY 128 Ca 0.05 -0.16 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 1req h GLY 128 CO -0.29 -0.03 -0.38 1.41 0.00 0.00 0.00 176.54 177.25 1req h LEU 129 N 0.49 0.00 -0.55 3.11 3.38 0.10 -0.87 115.31 120.96 1req h LEU 129 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1req h LEU 129 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1req h LEU 129 CO -0.34 0.38 0.00 -0.33 0.09 0.00 0.00 178.44 178.24 1req h GLU 130 N 0.00 0.00 -1.98 1.13 5.08 -1.20 -3.38 114.58 114.23 1req h GLU 130 Ca -0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 1req h GLU 130 Cb 0.84 0.00 -0.42 0.00 0.50 0.00 0.00 28.75 29.67 1req h GLU 130 CO 0.05 0.00 -0.69 0.54 -1.00 0.00 0.00 179.01 177.91 1req n ARG 131 N -2.87 3.26 -0.25 2.33 1.74 -0.78 -4.97 116.66 115.12 1req n ARG 131 Ca 0.03 -4.69 0.00 0.00 -0.77 0.00 0.00 57.85 52.42 1req n ARG 131 Cb 0.41 -2.22 0.00 0.00 -1.02 0.00 0.00 32.46 29.62 1req n ARG 131 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1req n GLY 132 N -0.33 2.03 3.76 -0.13 0.00 -1.23 -4.89 105.19 104.41 1req n GLY 132 Ca 0.34 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.95 1req n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1req s VAL 133 N -2.89 3.23 -0.02 1.61 1.01 -0.40 -4.80 120.40 118.14 1req s VAL 133 Ca 0.00 1.23 0.06 0.00 0.00 0.00 0.00 61.98 63.27 1req s VAL 133 Cb 0.00 -3.78 -0.09 0.00 0.00 0.00 0.00 36.38 32.51 1req s VAL 133 CO 0.00 0.29 0.10 0.35 0.00 0.00 0.00 175.10 175.85 1req n THR 134 N 1.09 0.09 -4.16 3.92 -2.24 0.15 -4.63 114.28 108.50 1req n THR 134 Ca -0.01 -0.16 -0.11 0.00 -2.27 0.00 0.00 64.05 61.50 1req n THR 134 Cb 0.44 0.08 -0.09 0.00 -2.10 0.00 0.00 70.33 68.66 1req n THR 134 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1req s SER 135 N -2.91 0.12 0.22 3.42 1.04 -0.73 -4.33 113.70 110.53 1req s SER 135 Ca -0.02 -1.29 0.10 0.00 0.48 0.00 0.00 55.95 55.21 1req s SER 135 Cb 0.03 0.41 -0.05 0.00 0.10 0.00 0.00 66.02 66.51 1req s SER 135 CO 0.24 -0.88 -0.18 -0.76 0.98 0.00 0.00 173.24 172.64 1req s LEU 136 N -3.13 2.53 -0.30 2.42 1.43 -0.88 -2.48 118.68 118.28 1req s LEU 136 Ca 0.35 -0.97 -0.01 0.00 -1.03 0.00 0.00 54.13 52.47 1req s LEU 136 Cb 0.06 -0.88 0.13 0.00 0.03 0.00 0.00 46.19 45.53 1req s LEU 136 CO 0.10 -0.05 0.28 -0.22 0.23 0.00 0.00 176.35 176.70 1req s LEU 137 N -3.16 -0.12 -0.17 1.79 2.96 -0.67 -1.46 118.68 117.86 1req s LEU 137 Ca 0.23 -0.89 -0.08 0.00 -0.22 0.00 0.00 54.13 53.17 1req s LEU 137 Cb -0.04 0.39 -0.04 0.00 0.50 0.00 0.00 46.19 47.00 1req s LEU 137 CO 0.09 -0.39 0.10 -0.76 -1.32 0.00 0.00 176.35 174.08 1req s LEU 138 N 2.25 4.07 -0.38 -0.68 1.02 -0.94 -0.81 118.68 123.22 1req s LEU 138 Ca 0.10 0.23 -0.20 0.00 0.02 0.00 0.00 54.13 54.29 1req s LEU 138 Cb -0.14 -2.02 0.01 0.00 0.02 0.00 0.00 46.19 44.05 1req s LEU 138 CO -0.31 0.25 0.59 -0.60 0.02 0.00 0.00 176.35 176.30 1req s ARG 139 N -0.08 3.52 -0.40 1.70 3.52 -0.61 -2.36 118.95 124.24 1req s ARG 139 Ca 0.09 -0.18 -0.14 0.00 -0.13 0.00 0.00 55.73 55.37 1req s ARG 139 Cb -0.12 -3.86 0.02 0.00 -1.56 0.00 0.00 34.95 29.44 1req s ARG 139 CO 0.00 -0.79 0.27 0.08 -0.81 0.00 0.00 175.30 174.05 1req s VAL 140 N 2.61 5.07 0.16 7.11 1.01 0.88 -1.44 120.40 135.80 1req s VAL 140 Ca 0.21 -0.69 -0.23 0.00 0.00 0.00 0.00 61.98 61.27 1req s VAL 140 Cb -0.15 -3.81 0.08 0.00 0.00 0.00 0.00 36.38 32.50 1req s VAL 140 CO 0.15 -0.27 1.06 -1.81 0.00 0.00 0.00 175.10 174.24 1req s ASP 141 N 1.65 -0.01 0.19 3.32 1.01 -0.79 -4.14 116.67 117.89 1req s ASP 141 Ca 0.04 -0.60 -0.04 0.00 0.71 0.00 0.00 52.55 52.66 1req s ASP 141 Cb -0.19 0.46 0.10 0.00 1.01 0.00 0.00 42.92 44.30 1req s ASP 141 CO 0.09 -0.90 1.51 1.55 0.21 0.00 0.00 175.17 177.63 1req h PRO 142 N 2.00 0.63 -0.81 8.23 0.13 -1.96 -2.95 132.00 137.27 1req h PRO 142 Ca -0.27 -0.37 -0.26 0.00 -0.87 0.00 0.00 66.00 64.23 1req h PRO 142 Cb 1.22 0.03 -0.16 0.00 0.13 0.00 0.00 31.00 32.22 1req h PRO 142 CO 0.34 0.99 0.33 -0.40 -0.23 0.00 0.00 178.00 179.03 1req n ASP 143 N -3.99 4.57 0.00 1.44 5.75 -1.26 -4.92 116.55 118.13 1req n ASP 143 Ca -0.03 -3.23 0.00 0.00 -0.01 0.00 0.00 54.79 51.53 1req n ASP 143 Cb 0.58 -0.76 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 1req n ASP 143 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1req n ALA 144 N -0.28 0.00 -2.64 2.12 0.00 -1.11 -4.61 120.51 113.98 1req n ALA 144 Ca 0.43 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.46 1req n ALA 144 Cb 1.40 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.79 1req n ALA 144 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1req s ILE 145 N 1.65 4.96 0.58 0.00 1.01 -0.52 -3.77 121.20 125.11 1req s ILE 145 Ca 0.00 1.24 -0.20 0.00 0.00 0.00 0.00 60.65 61.68 1req s ILE 145 Cb 0.00 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.45 1req s ILE 145 CO 0.00 0.02 1.29 0.00 0.00 0.00 0.00 174.94 176.25 1req n ALA 146 N 5.63 1.28 0.26 9.38 0.00 -1.25 -1.88 120.51 133.93 1req n ALA 146 Ca 0.01 0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.65 1req n ALA 146 Cb 0.49 -2.31 0.76 0.00 0.00 0.00 0.00 19.45 18.38 1req n ALA 146 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1req h PRO 147 N 1.08 0.00 -0.45 0.00 0.11 -1.93 -0.79 132.00 130.03 1req h PRO 147 Ca -0.50 0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.69 1req h PRO 147 Cb 1.32 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.35 1req h PRO 147 CO 0.55 0.00 -0.06 0.93 -0.21 0.00 0.00 178.00 179.22 1req h GLU 148 N 0.00 0.05 0.00 1.05 3.07 -1.99 -3.20 114.58 113.56 1req h GLU 148 Ca 0.01 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1req h GLU 148 Cb 0.07 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1req h GLU 148 CO -0.00 0.03 -0.12 0.72 -1.40 0.00 0.00 179.01 178.24 1req n HIS 149 N -5.27 0.64 -0.23 4.33 8.25 -0.33 -4.32 115.22 118.29 1req n HIS 149 Ca 0.04 0.19 -0.04 0.00 -0.26 0.00 0.00 57.72 57.64 1req n HIS 149 Cb 0.24 -0.78 0.02 0.00 1.12 0.00 0.00 29.99 30.59 1req n HIS 149 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1req h LEU 150 N 0.00 -1.16 -0.38 2.41 5.85 -1.49 -1.32 115.31 119.22 1req h LEU 150 Ca 0.00 0.24 0.08 0.00 0.84 0.00 0.00 57.88 59.03 1req h LEU 150 Cb 0.68 0.59 -0.07 0.00 0.37 0.00 0.00 40.66 42.23 1req h LEU 150 CO 0.00 -0.30 -0.08 -0.78 -0.34 0.00 0.00 178.44 176.95 1req h ASP 151 N -0.13 -0.31 -0.29 1.25 3.58 -1.83 -1.08 116.42 117.62 1req h ASP 151 Ca 0.26 0.11 -0.01 0.00 0.42 0.00 0.00 57.03 57.80 1req h ASP 151 Cb 0.56 0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.82 1req h ASP 151 CO -0.73 -0.11 0.12 -0.08 -2.88 0.00 0.00 179.24 175.56 1req h GLU 152 N 0.02 0.42 0.00 0.28 4.81 -1.52 -2.67 114.58 115.92 1req h GLU 152 Ca 0.19 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.27 1req h GLU 152 Cb 0.28 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1req h GLU 152 CO -0.38 0.43 -0.37 -0.39 -0.73 0.00 0.00 179.01 177.56 1req h VAL 153 N 0.32 1.13 -0.12 0.32 -1.51 -1.26 -1.10 116.25 114.02 1req h VAL 153 Ca 0.10 -1.35 0.00 0.00 -1.23 0.00 0.00 66.70 64.22 1req h VAL 153 Cb 0.16 1.75 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1req h VAL 153 CO -0.01 0.37 0.00 0.18 -1.23 0.00 0.00 177.57 176.88 1req n LEU 154 N -3.89 0.78 0.05 4.19 4.77 -0.42 -4.35 117.00 118.14 1req n LEU 154 Ca -0.01 -0.39 0.04 0.00 -0.03 0.00 0.00 56.01 55.62 1req n LEU 154 Cb 0.43 -0.13 0.46 0.00 -2.33 0.00 0.00 43.42 41.85 1req n LEU 154 CO 0.38 0.18 1.13 -1.28 -1.33 0.00 0.00 177.39 176.46 1req h SER 155 N 0.72 0.38 0.01 -1.43 0.87 -0.83 -1.21 113.55 112.05 1req h SER 155 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1req h SER 155 Cb 0.23 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1req h SER 155 CO 0.01 0.29 -0.10 0.47 -0.53 0.00 0.00 176.83 176.97 1req n ASP 156 N -4.47 2.12 -4.56 6.23 9.92 -1.26 -4.89 116.55 119.64 1req n ASP 156 Ca 0.02 -1.63 -0.40 0.00 -0.53 0.00 0.00 54.79 52.24 1req n ASP 156 Cb 0.08 0.08 -0.03 0.00 -0.64 0.00 0.00 41.12 40.61 1req n ASP 156 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1req s VAL 157 N -2.13 3.58 -0.23 2.53 1.01 -0.46 -4.94 120.40 119.76 1req s VAL 157 Ca 0.30 0.40 -0.28 0.00 0.00 0.00 0.00 61.98 62.39 1req s VAL 157 Cb 0.20 -4.33 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 1req s VAL 157 CO 0.38 -1.22 2.23 0.18 0.00 0.00 0.00 175.10 176.67 1req n LEU 158 N 10.86 3.23 0.23 3.92 4.77 -1.26 -4.81 117.00 133.94 1req n LEU 158 Ca 0.14 0.18 0.14 0.00 -0.03 0.00 0.00 56.01 56.43 1req n LEU 158 Cb 0.50 -1.56 0.35 0.00 -2.33 0.00 0.00 43.42 40.38 1req n LEU 158 CO 0.71 -0.72 0.87 -0.07 -1.33 0.00 0.00 177.39 176.85 1req h LEU 159 N 15.22 0.00 -0.05 2.23 3.38 -1.92 0.19 115.31 134.36 1req h LEU 159 Ca -0.41 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.33 1req h LEU 159 Cb 1.24 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.01 1req h LEU 159 CO 0.96 0.00 -0.89 1.05 0.09 0.00 0.00 178.44 179.65 1req h GLU 160 N 0.00 0.69 0.00 1.13 9.09 -1.87 -3.32 114.58 120.30 1req h GLU 160 Ca 0.00 -0.68 -0.08 0.00 0.05 0.00 0.00 59.36 58.65 1req h GLU 160 Cb 0.82 0.18 0.01 0.00 -1.65 0.00 0.00 28.75 28.10 1req h GLU 160 CO 0.00 1.27 -0.30 1.98 0.05 0.00 0.00 179.01 182.01 1req h MET 161 N 0.37 0.20 -5.42 1.06 -1.53 -1.80 -3.45 114.93 104.36 1req h MET 161 Ca -0.10 -0.22 -0.65 0.00 -3.44 0.00 0.00 59.70 55.29 1req h MET 161 Cb 1.55 0.06 -0.25 0.00 -0.55 0.00 0.00 31.60 32.41 1req h MET 161 CO 0.18 0.95 -0.73 0.99 0.14 0.00 0.00 176.91 178.43 1req s THR 162 N -3.11 3.32 -0.27 -0.77 2.01 0.62 -5.08 115.64 112.36 1req s THR 162 Ca -0.16 -0.57 -0.25 0.00 0.31 0.00 0.00 61.69 61.02 1req s THR 162 Cb 0.01 -2.40 -0.00 0.00 0.01 0.00 0.00 72.50 70.12 1req s THR 162 CO 0.75 0.52 0.85 -0.75 -0.69 0.00 0.00 174.62 175.31 1req s LYS 163 N 0.22 4.10 -0.04 4.92 2.20 -1.26 -4.56 119.74 125.33 1req s LYS 163 Ca -0.07 0.86 -0.11 0.00 -0.36 0.00 0.00 55.97 56.30 1req s LYS 163 Cb -0.15 -3.68 -0.05 0.00 -1.51 0.00 0.00 37.83 32.44 1req s LYS 163 CO 0.04 -0.62 0.29 0.08 -0.36 0.00 0.00 175.35 174.79 1req s VAL 164 N 2.98 5.24 -0.01 4.02 1.01 -1.25 -2.06 120.40 130.32 1req s VAL 164 Ca 0.36 0.50 0.04 0.00 0.00 0.00 0.00 61.98 62.88 1req s VAL 164 Cb -0.15 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 1req s VAL 164 CO 0.10 0.55 -0.15 -0.70 0.00 0.00 0.00 175.10 174.90 1req s GLU 165 N -1.21 1.23 0.33 2.72 2.12 -0.53 -1.81 118.70 121.55 1req s GLU 165 Ca 0.22 -0.53 0.08 0.00 0.36 0.00 0.00 54.97 55.10 1req s GLU 165 Cb -0.14 -1.17 -0.07 0.00 0.26 0.00 0.00 34.13 33.01 1req s GLU 165 CO 0.11 0.31 -0.06 0.14 -0.54 0.00 0.00 175.26 175.22 1req s VAL 166 N -0.31 1.96 -0.14 3.70 -7.23 -1.05 -2.20 120.40 115.14 1req s VAL 166 Ca 0.05 -2.14 -0.30 0.00 -1.81 0.00 0.00 61.98 57.78 1req s VAL 166 Cb -0.06 -2.66 0.12 0.00 0.56 0.00 0.00 36.38 34.34 1req s VAL 166 CO -0.00 -0.18 0.98 0.72 -0.31 0.00 0.00 175.10 176.30 1req s PHE 167 N -2.79 -0.37 -0.07 2.82 -0.71 -1.00 -4.01 117.98 111.85 1req s PHE 167 Ca 0.32 0.58 -0.15 0.00 -1.04 0.00 0.00 56.93 56.64 1req s PHE 167 Cb 0.04 0.46 0.03 0.00 -1.21 0.00 0.00 43.02 42.35 1req s PHE 167 CO 0.15 -0.37 0.37 0.45 -1.34 0.00 0.00 175.22 174.48 1req s SER 168 N -1.32 -0.32 -0.00 1.98 0.15 -1.26 -0.08 113.70 112.85 1req s SER 168 Ca -0.01 0.43 0.13 0.00 0.70 0.00 0.00 55.95 57.20 1req s SER 168 Cb -0.01 0.54 -0.15 0.00 -1.71 0.00 0.00 66.02 64.69 1req s SER 168 CO 0.00 -0.32 0.50 0.54 1.20 0.00 0.00 173.24 175.17 1req n ARG 169 N 1.95 2.33 -0.05 5.44 1.74 -1.26 -4.59 116.66 122.21 1req n ARG 169 Ca -0.18 -0.02 -0.02 0.00 -0.77 0.00 0.00 57.85 56.87 1req n ARG 169 Cb 0.57 -1.15 -0.12 0.00 -1.02 0.00 0.00 32.46 30.74 1req n ARG 169 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1req n TYR 170 N -1.42 0.00 -2.97 -1.55 4.01 -1.26 -4.88 117.16 109.09 1req n TYR 170 Ca 0.02 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.73 1req n TYR 170 Cb 0.23 -0.62 -0.00 0.00 -0.31 0.00 0.00 39.34 38.64 1req n TYR 170 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1req s ASP 171 N -4.53 -1.41 0.19 7.72 -1.08 -1.26 -5.03 116.67 111.26 1req s ASP 171 Ca -0.07 -1.34 -0.07 0.00 -0.52 0.00 0.00 52.55 50.54 1req s ASP 171 Cb 0.07 1.88 0.10 0.00 -1.46 0.00 0.00 42.92 43.50 1req s ASP 171 CO 0.66 -0.11 1.59 1.56 0.52 0.00 0.00 175.17 179.39 1req h GLN 172 N 5.90 0.90 -0.39 4.34 4.20 -1.92 -2.33 115.11 125.81 1req h GLN 172 Ca 0.06 -0.37 -0.01 0.00 0.06 0.00 0.00 58.65 58.39 1req h GLN 172 Cb 1.14 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.86 1req h GLN 172 CO 0.06 1.02 0.20 0.78 -0.67 0.00 0.00 178.83 180.21 1req h GLY 173 N 0.92 0.60 0.86 3.46 0.00 -1.97 0.31 103.07 107.25 1req h GLY 173 Ca 0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 1req h GLY 173 CO 0.06 0.28 0.04 0.00 0.00 0.00 0.00 176.54 176.92 1req h ALA 174 N 1.05 0.16 0.05 3.60 0.00 -1.97 0.14 119.26 122.29 1req h ALA 174 Ca 0.14 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1req h ALA 174 Cb 0.10 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1req h ALA 174 CO -0.02 -0.23 -0.33 0.00 0.00 0.00 0.00 179.25 178.67 1req h ALA 175 N 0.87 -0.52 -0.15 0.00 0.00 -1.32 0.21 119.26 118.36 1req h ALA 175 Ca 0.04 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1req h ALA 175 Cb 0.20 0.56 -0.06 0.00 0.00 0.00 0.00 17.79 18.49 1req h ALA 175 CO -0.00 -0.86 -0.32 0.00 0.00 0.00 0.00 179.25 178.07 1req h ALA 176 N 0.17 -0.36 -0.24 0.00 0.00 -0.13 -1.69 119.26 117.00 1req h ALA 176 Ca 0.05 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.04 1req h ALA 176 Cb 0.57 0.62 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 1req h ALA 176 CO -0.24 -0.79 -0.17 1.49 0.00 0.00 0.00 179.25 179.54 1req h GLU 177 N -0.39 -0.15 -0.58 0.00 4.57 -0.46 -2.66 114.58 114.91 1req h GLU 177 Ca 0.10 0.01 0.12 0.00 -1.18 0.00 0.00 59.36 58.41 1req h GLU 177 Cb 0.54 0.03 -0.10 0.00 -0.16 0.00 0.00 28.75 29.07 1req h GLU 177 CO -0.36 -0.10 -0.05 0.00 -1.18 0.00 0.00 179.01 177.31 1req h ALA 178 N 0.99 0.51 -0.53 2.92 0.00 -0.04 -2.38 119.26 120.73 1req h ALA 178 Ca 0.14 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 1req h ALA 178 Cb 0.36 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1req h ALA 178 CO -0.34 -0.41 0.08 1.25 0.00 0.00 0.00 179.25 179.84 1req h LEU 179 N 0.07 0.84 -0.86 0.00 5.85 -1.02 -3.23 115.31 116.96 1req h LEU 179 Ca 0.30 -0.26 -0.09 0.00 0.84 0.00 0.00 57.88 58.67 1req h LEU 179 Cb 0.47 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1req h LEU 179 CO -0.53 0.89 -0.09 -0.37 -0.34 0.00 0.00 178.44 177.99 1req h VAL 180 N 0.76 1.25 -0.26 1.05 -1.51 -1.13 -2.87 116.25 113.54 1req h VAL 180 Ca 0.16 -1.12 0.06 0.00 -1.23 0.00 0.00 66.70 64.57 1req h VAL 180 Cb 0.41 1.03 -0.07 0.00 -2.13 0.00 0.00 31.29 30.53 1req h VAL 180 CO 0.01 0.38 -0.18 0.28 -1.23 0.00 0.00 177.57 176.84 1req h SER 181 N 0.68 -0.59 -0.47 4.19 0.02 -1.53 0.24 113.55 116.10 1req h SER 181 Ca 0.12 0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 1req h SER 181 Cb 0.56 0.30 -0.02 0.00 0.14 0.00 0.00 62.40 63.37 1req h SER 181 CO 0.03 -0.22 0.28 0.58 -1.14 0.00 0.00 176.83 176.37 1req h VAL 182 N -0.16 1.15 0.00 2.27 2.07 -1.52 0.35 116.25 120.39 1req h VAL 182 Ca 0.14 -0.35 -0.13 0.00 0.82 0.00 0.00 66.70 67.19 1req h VAL 182 Cb 0.38 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 1req h VAL 182 CO -0.36 0.16 -0.60 1.88 0.02 0.00 0.00 177.57 178.67 1req h TYR 183 N 0.67 0.00 0.00 1.57 -1.99 -1.42 -3.15 116.97 112.66 1req h TYR 183 Ca 0.18 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.71 1req h TYR 183 Cb -0.00 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.70 1req h TYR 183 CO 0.00 0.60 -1.04 0.93 -0.00 0.00 0.00 178.16 178.65 1req h GLU 184 N 0.00 0.00 -0.84 4.88 5.08 -0.12 -3.37 114.58 120.21 1req h GLU 184 Ca -0.01 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1req h GLU 184 Cb 1.10 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.29 1req h GLU 184 CO 0.08 0.75 0.12 -2.13 -1.00 0.00 0.00 179.01 176.83 1req n ARG 185 N -3.23 2.77 -4.13 2.33 0.63 0.11 -4.89 116.66 110.24 1req n ARG 185 Ca -0.03 -1.79 -0.12 0.00 -0.92 0.00 0.00 57.85 54.99 1req n ARG 185 Cb 0.91 -1.86 -0.11 0.00 0.45 0.00 0.00 32.46 31.85 1req n ARG 185 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1req s SER 186 N -0.41 1.09 -0.96 6.15 0.15 -1.25 -5.00 113.70 113.48 1req s SER 186 Ca 0.32 -0.82 -0.22 0.00 0.70 0.00 0.00 55.95 55.93 1req s SER 186 Cb 0.25 0.06 0.08 0.00 -1.71 0.00 0.00 66.02 64.70 1req s SER 186 CO 0.08 -0.34 1.31 1.51 1.20 0.00 0.00 173.24 177.00 1req s ASP 187 N -2.45 6.52 -0.30 5.45 1.47 -1.26 -4.82 116.67 121.28 1req s ASP 187 Ca 0.03 -1.59 -0.17 0.00 1.18 0.00 0.00 52.55 52.01 1req s ASP 187 Cb -0.01 -2.51 0.18 0.00 -0.34 0.00 0.00 42.92 40.25 1req s ASP 187 CO -0.02 -1.37 1.15 -0.54 0.68 0.00 0.00 175.17 175.07 1req s LYS 188 N 4.20 0.17 -0.40 2.11 1.02 -1.26 -5.11 119.74 120.46 1req s LYS 188 Ca 0.40 0.34 -0.41 0.00 0.02 0.00 0.00 55.97 56.33 1req s LYS 188 Cb -0.03 0.13 -0.16 0.00 -0.52 0.00 0.00 37.83 37.25 1req s LYS 188 CO -0.08 -0.04 2.01 -2.30 -0.92 0.00 0.00 175.35 174.02 1req n PRO 189 N 4.00 0.60 -0.27 -1.68 -0.02 -1.26 -4.86 135.00 131.52 1req n PRO 189 Ca -0.13 0.19 -0.07 0.00 -2.02 0.00 0.00 63.50 61.47 1req n PRO 189 Cb 0.56 -1.94 -0.06 0.00 -0.02 0.00 0.00 33.50 32.03 1req n PRO 189 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1req n ALA 190 N 7.44 -0.41 0.23 3.55 0.00 -1.26 -1.66 120.51 128.40 1req n ALA 190 Ca 0.42 0.55 0.14 0.00 0.00 0.00 0.00 53.44 54.54 1req n ALA 190 Cb 0.08 -0.05 0.74 0.00 0.00 0.00 0.00 19.45 20.22 1req n ALA 190 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1req h LYS 191 N 0.00 0.00 -0.09 0.00 -0.00 -1.82 -2.43 116.57 112.23 1req h LYS 191 Ca 0.10 0.00 -0.09 0.00 -0.00 0.00 0.00 60.65 60.66 1req h LYS 191 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.50 1req h LYS 191 CO -0.60 0.00 -0.31 -0.44 -0.00 0.00 0.00 179.45 178.10 1req h ASP 192 N 0.00 0.42 -3.79 7.07 5.19 -1.65 -2.91 116.42 120.75 1req h ASP 192 Ca 0.00 -0.62 -0.52 0.00 -0.62 0.00 0.00 57.03 55.27 1req h ASP 192 Cb 0.18 -0.12 0.06 0.00 0.18 0.00 0.00 39.33 39.62 1req h ASP 192 CO 0.00 0.97 0.63 -0.76 -3.12 0.00 0.00 179.24 176.96 1req s LEU 193 N -8.75 4.44 -0.03 1.55 1.43 -0.91 -4.78 118.68 111.62 1req s LEU 193 Ca -0.14 2.61 0.06 0.00 -1.03 0.00 0.00 54.13 55.63 1req s LEU 193 Cb 0.04 -3.64 -0.01 0.00 0.03 0.00 0.00 46.19 42.61 1req s LEU 193 CO 0.78 -0.50 -0.22 0.00 0.23 0.00 0.00 176.35 176.64 1req s ALA 194 N -0.94 1.86 -0.20 4.21 0.00 -1.25 -3.14 121.76 122.30 1req s ALA 194 Ca 0.50 -0.92 -0.26 0.00 0.00 0.00 0.00 51.96 51.28 1req s ALA 194 Cb -0.39 -0.53 0.07 0.00 0.00 0.00 0.00 23.12 22.27 1req s ALA 194 CO 0.49 0.40 0.69 -0.48 0.00 0.00 0.00 175.76 176.87 1req s LEU 195 N -0.30 -0.65 -0.20 0.00 2.34 -1.26 -3.97 118.68 114.64 1req s LEU 195 Ca 0.02 1.20 -0.04 0.00 0.06 0.00 0.00 54.13 55.38 1req s LEU 195 Cb -0.11 2.43 -0.02 0.00 -0.56 0.00 0.00 46.19 47.93 1req s LEU 195 CO 0.01 -0.35 -0.04 0.20 -1.06 0.00 0.00 176.35 175.12 1req s ASN 196 N -0.09 4.50 -0.00 1.48 -0.87 -0.75 -1.45 114.94 117.76 1req s ASN 196 Ca -0.03 -0.29 0.04 0.00 -1.57 0.00 0.00 52.86 51.00 1req s ASN 196 Cb -0.04 -1.76 -0.25 0.00 -0.02 0.00 0.00 41.25 39.19 1req s ASN 196 CO 0.04 0.05 0.82 -0.07 -2.57 0.00 0.00 177.10 175.36 1req h LEU 197 N 7.61 0.18 0.00 0.60 3.38 -1.19 -2.77 115.31 123.12 1req h LEU 197 Ca -0.37 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.31 1req h LEU 197 Cb 1.18 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1req h LEU 197 CO 0.60 1.25 0.00 0.61 0.09 0.00 0.00 178.44 180.99 1req n GLY 198 N 1.60 0.38 3.76 0.83 0.00 -1.22 -4.45 105.19 106.09 1req n GLY 198 Ca -0.15 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.56 1req n GLY 198 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1req s LEU 199 N 0.00 4.51 -0.48 0.99 2.01 0.15 -4.46 118.68 121.40 1req s LEU 199 Ca 0.00 2.35 0.06 0.00 0.01 0.00 0.00 54.13 56.55 1req s LEU 199 Cb 0.00 -3.63 0.19 0.00 0.01 0.00 0.00 46.19 42.76 1req s LEU 199 CO 0.00 -0.27 0.74 -0.62 1.01 0.00 0.00 176.35 177.21 1req s ASP 200 N -0.60 -1.37 0.18 2.29 2.15 -1.26 -1.93 116.67 116.12 1req s ASP 200 Ca 0.47 -1.41 -0.14 0.00 0.43 0.00 0.00 52.55 51.91 1req s ASP 200 Cb -0.34 1.79 0.11 0.00 -0.30 0.00 0.00 42.92 44.18 1req s ASP 200 CO 0.43 -0.07 1.80 -0.65 -0.17 0.00 0.00 175.17 176.50 1req h PRO 201 N 5.40 0.54 -0.59 4.34 0.11 -1.93 -2.29 132.00 137.58 1req h PRO 201 Ca 0.05 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.03 1req h PRO 201 Cb 1.13 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 1req h PRO 201 CO 0.02 0.36 -0.02 0.82 -0.21 0.00 0.00 178.00 178.97 1req h ILE 202 N 0.55 1.27 -0.42 4.15 2.04 -1.94 -1.58 117.51 121.58 1req h ILE 202 Ca 0.21 -1.17 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 1req h ILE 202 Cb 0.06 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 1req h ILE 202 CO -0.12 0.42 0.25 1.23 0.00 0.00 0.00 178.15 179.94 1req h GLY 203 N 0.94 0.61 0.46 5.37 0.00 -1.91 0.22 103.07 108.77 1req h GLY 203 Ca 0.16 -0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.25 1req h GLY 203 CO 0.03 0.25 -0.35 -2.75 0.00 0.00 0.00 176.54 173.72 1req h PHE 204 N 0.56 -0.96 -0.38 5.60 3.04 -1.36 -0.33 116.94 123.11 1req h PHE 204 Ca 0.15 0.02 0.05 0.00 3.98 0.00 0.00 57.97 62.16 1req h PHE 204 Cb 0.00 0.40 -0.08 0.00 2.56 0.00 0.00 35.95 38.83 1req h PHE 204 CO -0.03 -0.47 -0.53 0.00 -2.02 0.00 0.00 178.31 175.26 1req h ALA 205 N -0.07 -0.77 -0.94 2.41 0.00 -1.10 0.19 119.26 118.98 1req h ALA 205 Ca 0.01 -0.00 0.28 0.00 0.00 0.00 0.00 54.91 55.20 1req h ALA 205 Cb 0.63 1.11 -0.15 0.00 0.00 0.00 0.00 17.79 19.37 1req h ALA 205 CO -0.16 -1.02 0.32 0.00 0.00 0.00 0.00 179.25 178.39 1req h ALA 206 N -0.12 1.52 0.00 0.00 0.00 -0.40 0.40 119.26 120.66 1req h ALA 206 Ca 0.07 0.24 -0.16 0.00 0.00 0.00 0.00 54.91 55.05 1req h ALA 206 Cb 0.57 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1req h ALA 206 CO -0.56 -0.56 -0.77 -0.07 0.00 0.00 0.00 179.25 177.28 1req h LEU 207 N 0.18 0.00 0.00 0.00 3.38 0.13 -2.10 115.31 116.90 1req h LEU 207 Ca 0.64 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.42 1req h LEU 207 Cb 1.39 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.10 1req h LEU 207 CO -0.70 0.77 -2.15 0.00 0.09 0.00 0.00 178.44 176.46 1req n GLN 208 N -3.50 0.67 -0.78 1.13 1.13 0.54 -2.71 117.38 113.87 1req n GLN 208 Ca -0.00 -0.08 0.00 0.00 -1.94 0.00 0.00 57.00 54.98 1req n GLN 208 Cb 0.78 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 29.59 1req n GLN 208 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1req n GLY 209 N 1.50 0.61 0.59 1.08 0.00 0.13 -3.35 105.19 105.75 1req n GLY 209 Ca -0.18 -0.74 -0.03 0.00 0.00 0.00 0.00 46.02 45.07 1req n GLY 209 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1req n THR 210 N -2.74 0.00 -4.51 2.61 -2.24 -1.23 -4.91 114.28 101.26 1req n THR 210 Ca 0.00 -0.28 -0.32 0.00 -2.27 0.00 0.00 64.05 61.18 1req n THR 210 Cb 0.04 -0.98 -0.11 0.00 -2.10 0.00 0.00 70.33 67.19 1req n THR 210 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1req s GLU 211 N -2.44 2.51 -0.06 -0.78 1.03 -1.26 -4.69 118.70 113.00 1req s GLU 211 Ca 0.09 -0.74 -0.30 0.00 0.03 0.00 0.00 54.97 54.06 1req s GLU 211 Cb -0.01 -2.47 -0.05 0.00 -0.80 0.00 0.00 34.13 30.80 1req s GLU 211 CO 0.06 0.60 1.67 -1.25 -1.33 0.00 0.00 175.26 175.01 1req s PRO 212 N -1.34 4.14 -1.03 -4.83 0.04 -1.26 -4.89 135.00 125.82 1req s PRO 212 Ca 0.16 2.17 -0.17 0.00 0.04 0.00 0.00 61.00 63.20 1req s PRO 212 Cb -0.11 -4.00 0.15 0.00 0.04 0.00 0.00 34.50 30.57 1req s PRO 212 CO 0.06 -0.90 1.23 0.34 0.04 0.00 0.00 177.00 177.77 1req s ASP 213 N 3.53 6.79 0.00 6.66 -1.08 -1.26 -4.86 116.67 126.45 1req s ASP 213 Ca 0.74 -2.40 0.28 0.00 -0.52 0.00 0.00 52.55 50.65 1req s ASP 213 Cb -0.33 -2.39 1.00 0.00 -1.46 0.00 0.00 42.92 39.73 1req s ASP 213 CO 0.30 -0.94 1.73 0.18 0.52 0.00 0.00 175.17 176.97 1req n LEU 214 N 6.15 0.46 0.11 -1.34 4.32 -1.26 -4.13 117.00 121.31 1req n LEU 214 Ca 0.28 0.06 0.13 0.00 -0.02 0.00 0.00 56.01 56.46 1req n LEU 214 Cb 0.47 -0.25 0.45 0.00 -1.62 0.00 0.00 43.42 42.47 1req n LEU 214 CO 0.54 0.09 0.88 0.35 -1.22 0.00 0.00 177.39 178.03 1req n THR 215 N -1.14 0.66 0.97 -5.08 -2.24 -1.26 -3.68 114.28 102.50 1req n THR 215 Ca 0.11 -0.08 0.13 0.00 -2.27 0.00 0.00 64.05 61.94 1req n THR 215 Cb 0.31 -0.79 0.40 0.00 -2.10 0.00 0.00 70.33 68.15 1req n THR 215 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1req n VAL 216 N -2.20 0.03 0.11 2.28 3.14 -1.26 -4.33 118.33 116.11 1req n VAL 216 Ca 0.04 -0.02 -0.13 0.00 -2.96 0.00 0.00 64.34 61.28 1req n VAL 216 Cb 0.35 -0.10 -0.06 0.00 -1.06 0.00 0.00 33.84 32.98 1req n VAL 216 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1req h LEU 217 N 0.00 -0.58 -0.83 6.55 3.38 -1.85 -2.55 115.31 119.43 1req h LEU 217 Ca 0.00 0.07 0.13 0.00 0.09 0.00 0.00 57.88 58.17 1req h LEU 217 Cb 0.52 0.22 -0.09 0.00 0.09 0.00 0.00 40.66 41.40 1req h LEU 217 CO 0.00 -0.29 0.43 1.23 0.09 0.00 0.00 178.44 179.90 1req h GLY 218 N -0.40 1.32 0.09 0.83 0.00 -1.85 0.16 103.07 103.22 1req h GLY 218 Ca 0.02 -0.26 0.09 0.00 0.00 0.00 0.00 47.33 47.18 1req h GLY 218 CO -0.11 0.00 -0.14 -1.80 0.00 0.00 0.00 176.54 174.49 1req h ASP 219 N 0.65 -0.51 -0.43 0.19 1.82 -1.81 -2.01 116.42 114.32 1req h ASP 219 Ca 0.44 0.14 -0.13 0.00 -0.39 0.00 0.00 57.03 57.08 1req h ASP 219 Cb 0.57 0.30 -0.01 0.00 0.68 0.00 0.00 39.33 40.88 1req h ASP 219 CO -0.33 -0.18 -0.25 -0.50 -1.61 0.00 0.00 179.24 176.36 1req h TRP 220 N -0.05 1.09 -0.46 0.28 -0.00 -0.82 -2.53 115.95 113.46 1req h TRP 220 Ca 0.20 -0.28 0.08 0.00 -0.00 0.00 0.00 58.89 58.89 1req h TRP 220 Cb 0.36 -0.25 -0.06 0.00 -0.00 0.00 0.00 29.16 29.21 1req h TRP 220 CO -0.40 1.10 0.09 0.28 -0.00 0.00 0.00 178.44 179.51 1req h VAL 221 N 0.77 0.74 0.00 1.49 2.07 -0.32 -2.76 116.25 118.24 1req h VAL 221 Ca 0.09 -0.08 -0.11 0.00 0.82 0.00 0.00 66.70 67.42 1req h VAL 221 Cb 0.83 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1req h VAL 221 CO 0.07 0.04 -0.54 0.03 0.02 0.00 0.00 177.57 177.19 1req h ARG 222 N 0.22 0.00 -0.45 1.57 3.08 -1.21 -3.02 114.38 114.58 1req h ARG 222 Ca 0.23 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.22 1req h ARG 222 Cb 0.30 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1req h ARG 222 CO -0.30 0.54 0.04 -0.09 -1.07 0.00 0.00 179.97 179.09 1req h ARG 223 N 0.00 0.70 0.00 0.04 9.65 -1.15 -1.87 114.38 121.74 1req h ARG 223 Ca -0.01 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 58.72 1req h ARG 223 Cb 0.99 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.47 1req h ARG 223 CO 0.07 0.69 0.00 -0.11 2.80 0.00 0.00 179.97 183.42 1req n LEU 224 N -4.26 0.73 0.28 3.80 7.94 -1.20 -4.15 117.00 120.14 1req n LEU 224 Ca 0.03 0.63 0.16 0.00 -1.11 0.00 0.00 56.01 55.72 1req n LEU 224 Cb 0.25 -0.48 0.80 0.00 0.53 0.00 0.00 43.42 44.52 1req n LEU 224 CO 0.40 -0.42 1.01 0.00 -1.11 0.00 0.00 177.39 177.27 1req h ALA 225 N 2.36 1.11 -0.24 1.96 0.00 -1.20 -2.90 119.26 120.36 1req h ALA 225 Ca 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1req h ALA 225 Cb 0.51 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1req h ALA 225 CO 0.00 0.08 0.02 1.57 0.00 0.00 0.00 179.25 180.92 1req h LYS 226 N 0.00 0.40 -7.39 0.00 2.10 -1.77 -3.44 116.57 106.47 1req h LYS 226 Ca -0.00 -0.12 -0.50 0.00 -2.00 0.00 0.00 60.65 58.03 1req h LYS 226 Cb 0.35 -0.04 0.09 0.00 -0.90 0.00 0.00 32.23 31.73 1req h LYS 226 CO 0.01 0.56 0.38 -0.06 -2.00 0.00 0.00 179.45 178.34 1req s PHE 227 N -5.09 3.20 0.07 0.07 0.40 -1.09 -2.76 117.98 112.79 1req s PHE 227 Ca -0.14 1.24 -0.02 0.00 -0.60 0.00 0.00 56.93 57.41 1req s PHE 227 Cb 0.07 -2.95 -0.01 0.00 0.51 0.00 0.00 43.02 40.64 1req s PHE 227 CO 0.74 -1.24 -0.04 0.45 0.70 0.00 0.00 175.22 175.82 1req n SER 228 N -3.10 -0.46 0.09 1.36 2.88 -1.10 -4.79 113.62 108.50 1req n SER 228 Ca 0.07 0.04 0.13 0.00 -1.33 0.00 0.00 58.87 57.78 1req n SER 228 Cb 0.55 -0.08 0.44 0.00 -0.75 0.00 0.00 64.21 64.38 1req n SER 228 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1req n PRO 229 N 0.19 0.22 0.15 -1.46 -0.04 -1.26 -2.09 135.00 130.71 1req n PRO 229 Ca 0.00 0.21 0.06 0.00 -0.04 0.00 0.00 63.50 63.72 1req n PRO 229 Cb 0.05 -1.77 0.06 0.00 -0.04 0.00 0.00 33.50 31.80 1req n PRO 229 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1req h ASP 230 N 0.00 0.00 -3.87 3.54 5.19 -1.91 -3.47 116.42 115.91 1req h ASP 230 Ca 0.00 0.00 -0.56 0.00 -0.62 0.00 0.00 57.03 55.85 1req h ASP 230 Cb 0.67 0.00 0.16 0.00 0.18 0.00 0.00 39.33 40.34 1req h ASP 230 CO 0.00 0.34 0.32 -1.20 -3.12 0.00 0.00 179.24 175.58 1req n SER 231 N -3.14 1.41 -4.03 6.45 7.64 -0.89 -4.83 113.62 116.23 1req n SER 231 Ca 0.02 0.81 -0.15 0.00 1.01 0.00 0.00 58.87 60.55 1req n SER 231 Cb 0.67 -1.48 -0.13 0.00 -1.01 0.00 0.00 64.21 62.27 1req n SER 231 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1req s ARG 232 N -3.12 0.53 -0.05 1.43 3.00 -0.53 -4.74 118.95 115.48 1req s ARG 232 Ca 0.80 -0.52 0.03 0.00 0.00 0.00 0.00 55.73 56.03 1req s ARG 232 Cb -0.39 -0.41 -0.05 0.00 0.00 0.00 0.00 34.95 34.10 1req s ARG 232 CO 0.43 0.09 -0.00 0.00 0.00 0.00 0.00 175.30 175.82 1req n ALA 233 N 2.12 1.88 -2.80 2.13 0.00 0.30 -0.74 120.51 123.40 1req n ALA 233 Ca -0.18 -0.29 -0.35 0.00 0.00 0.00 0.00 53.44 52.62 1req n ALA 233 Cb 0.56 0.22 -0.09 0.00 0.00 0.00 0.00 19.45 20.14 1req n ALA 233 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1req s VAL 234 N -2.11 4.84 -0.33 0.00 1.01 -0.17 0.34 120.40 123.98 1req s VAL 234 Ca -0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 1req s VAL 234 Cb 0.02 -3.13 0.11 0.00 0.00 0.00 0.00 36.38 33.38 1req s VAL 234 CO 0.17 0.54 0.14 -0.89 0.00 0.00 0.00 175.10 175.06 1req s THR 235 N -0.32 0.66 -0.59 3.92 2.01 -0.81 -0.10 115.64 120.41 1req s THR 235 Ca 0.09 -1.47 -0.27 0.00 0.31 0.00 0.00 61.69 60.35 1req s THR 235 Cb -0.12 -1.50 -0.01 0.00 0.01 0.00 0.00 72.50 70.88 1req s THR 235 CO 0.02 -0.76 1.75 -0.63 -0.69 0.00 0.00 174.62 174.30 1req s ILE 236 N 1.46 3.45 -0.90 1.82 1.01 0.51 -4.35 121.20 124.20 1req s ILE 236 Ca 0.12 0.31 -0.25 0.00 0.00 0.00 0.00 60.65 60.83 1req s ILE 236 Cb -0.19 -4.05 0.04 0.00 0.01 0.00 0.00 42.46 38.27 1req s ILE 236 CO -0.21 -0.97 1.38 -0.62 0.00 0.00 0.00 174.94 174.53 1req s ASP 237 N 7.05 6.35 0.41 3.58 2.15 -1.26 -1.78 116.67 133.17 1req s ASP 237 Ca 0.64 -1.02 0.23 0.00 0.43 0.00 0.00 52.55 52.83 1req s ASP 237 Cb -0.13 -2.57 0.36 0.00 -0.30 0.00 0.00 42.92 40.28 1req s ASP 237 CO 0.22 -1.66 1.59 0.00 -0.17 0.00 0.00 175.17 175.16 1req h ALA 238 N 9.92 0.97 -0.05 3.66 0.00 -1.64 -2.88 119.26 129.24 1req h ALA 238 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1req h ALA 238 Cb 1.03 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1req h ALA 238 CO 1.37 0.00 -0.20 -0.97 0.00 0.00 0.00 179.25 179.44 1req h ASN 239 N 0.00 0.08 -0.81 0.00 -0.73 -1.85 -1.97 115.58 110.29 1req h ASN 239 Ca 0.00 -0.02 0.06 0.00 1.87 0.00 0.00 56.30 58.21 1req h ASN 239 Cb 0.98 -0.02 -0.06 0.00 0.27 0.00 0.00 38.32 39.49 1req h ASN 239 CO 0.00 0.29 0.50 0.40 -0.37 0.00 0.00 177.43 178.25 1req h ILE 240 N 0.08 1.04 -0.49 2.57 2.04 -1.85 0.39 117.51 121.29 1req h ILE 240 Ca 0.01 -0.32 -0.13 0.00 1.00 0.00 0.00 64.86 65.43 1req h ILE 240 Cb 0.41 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 1req h ILE 240 CO 0.03 0.17 -0.21 1.88 0.00 0.00 0.00 178.15 180.02 1req h TYR 241 N 0.92 1.15 -0.01 1.37 0.05 -1.55 -3.13 116.97 115.78 1req h TYR 241 Ca 0.35 -0.28 0.03 0.00 0.05 0.00 0.00 58.73 58.88 1req h TYR 241 Cb 0.15 -0.27 -0.06 0.00 1.01 0.00 0.00 36.73 37.56 1req h TYR 241 CO -0.04 1.11 -0.48 1.25 -1.05 0.00 0.00 178.16 178.94 1req h HIS 242 N 0.87 -1.40 -0.75 4.88 2.76 -1.13 -1.93 115.15 118.44 1req h HIS 242 Ca 0.11 0.05 0.22 0.00 -2.20 0.00 0.00 60.37 58.55 1req h HIS 242 Cb 0.79 0.61 -0.03 0.00 1.55 0.00 0.00 27.41 30.33 1req h HIS 242 CO 0.05 -0.54 0.54 -0.91 -1.30 0.00 0.00 177.93 175.77 1req h ASN 243 N -0.63 0.02 1.04 3.26 4.21 -1.03 0.16 115.58 122.61 1req h ASN 243 Ca 0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.54 1req h ASN 243 Cb 0.70 -0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.89 1req h ASN 243 CO -0.35 0.01 0.00 0.00 -1.29 0.00 0.00 177.43 175.80 1req n ALA 244 N -2.68 1.96 0.00 -0.83 0.00 -0.78 -3.65 120.51 114.53 1req n ALA 244 Ca 0.15 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1req n ALA 244 Cb 0.81 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1req n ALA 244 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1req n GLY 245 N 0.64 0.45 3.78 0.00 0.00 0.54 -4.90 105.19 105.70 1req n GLY 245 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1req n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req s ALA 246 N -1.11 3.17 1.00 4.61 0.00 -0.96 -4.10 121.76 124.37 1req s ALA 246 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.66 1req s ALA 246 Cb 0.00 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.86 1req s ALA 246 CO 0.00 -0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.04 1req n GLY 247 N 0.55 -1.10 0.07 0.00 0.00 -1.26 -4.50 105.19 98.94 1req n GLY 247 Ca 0.03 -1.59 -0.13 0.00 0.00 0.00 0.00 46.02 44.33 1req n GLY 247 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1req h ASP 248 N -0.04 0.07 0.52 1.61 3.32 -1.97 -2.99 116.42 116.94 1req h ASP 248 Ca 0.00 -0.36 -0.02 0.00 0.02 0.00 0.00 57.03 56.67 1req h ASP 248 Cb 0.00 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1req h ASP 248 CO 0.00 0.42 -0.50 0.58 -1.72 0.00 0.00 179.24 178.01 1req h VAL 249 N -0.27 0.00 -0.13 -1.35 2.07 -1.91 -1.86 116.25 112.79 1req h VAL 249 Ca 0.01 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.58 1req h VAL 249 Cb 0.38 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.10 1req h VAL 249 CO 0.00 0.00 -0.20 0.00 0.02 0.00 0.00 177.57 177.39 1req h ALA 250 N -0.94 -0.15 -0.93 1.67 0.00 -1.94 -1.33 119.26 115.64 1req h ALA 250 Ca -0.07 0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.97 1req h ALA 250 Cb 0.88 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 19.00 1req h ALA 250 CO -0.05 -0.66 0.58 1.49 0.00 0.00 0.00 179.25 180.61 1req h GLU 251 N -0.26 0.99 0.22 0.00 4.81 -1.36 -1.14 114.58 117.84 1req h GLU 251 Ca 0.10 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1req h GLU 251 Cb 0.40 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.56 1req h GLU 251 CO -0.28 0.65 -0.11 1.25 -0.73 0.00 0.00 179.01 179.79 1req h LEU 252 N 1.02 -0.25 -0.49 1.64 5.85 -1.04 -2.65 115.31 119.39 1req h LEU 252 Ca 0.42 -0.26 0.10 0.00 0.84 0.00 0.00 57.88 58.98 1req h LEU 252 Cb 0.25 0.06 -0.10 0.00 0.37 0.00 0.00 40.66 41.24 1req h LEU 252 CO -0.20 0.16 -0.22 0.00 -0.34 0.00 0.00 178.44 177.85 1req h ALA 253 N -0.10 0.14 0.00 1.25 0.00 -0.99 -1.23 119.26 118.33 1req h ALA 253 Ca -0.03 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1req h ALA 253 Cb 0.49 0.54 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1req h ALA 253 CO 0.05 -0.56 0.00 0.91 0.00 0.00 0.00 179.25 179.65 1req n TRP 254 N -5.40 0.00 0.05 0.00 8.01 -0.45 -0.92 117.44 118.73 1req n TRP 254 Ca 0.04 0.00 -0.20 0.00 -1.31 0.00 0.00 57.50 56.02 1req n TRP 254 Cb 0.31 -0.23 -0.13 0.00 -2.01 0.00 0.00 31.31 29.25 1req n TRP 254 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1req h ALA 255 N 3.31 -0.02 -0.03 6.99 0.00 -0.85 -3.12 119.26 125.54 1req h ALA 255 Ca 0.00 -0.69 -0.06 0.00 0.00 0.00 0.00 54.91 54.16 1req h ALA 255 Cb 0.19 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1req h ALA 255 CO 0.00 0.48 -0.20 -0.07 0.00 0.00 0.00 179.25 179.47 1req h LEU 256 N -0.06 0.23 0.02 0.00 3.38 -0.87 -2.00 115.31 116.01 1req h LEU 256 Ca -0.14 -0.68 0.03 0.00 0.09 0.00 0.00 57.88 57.17 1req h LEU 256 Cb 1.66 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 42.29 1req h LEU 256 CO 0.18 0.87 -0.38 0.00 0.09 0.00 0.00 178.44 179.20 1req h ALA 257 N 0.36 -0.59 -0.55 1.53 0.00 -1.18 0.17 119.26 119.00 1req h ALA 257 Ca -0.02 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.90 1req h ALA 257 Cb 0.88 0.66 -0.03 0.00 0.00 0.00 0.00 17.79 19.30 1req h ALA 257 CO 0.04 -0.91 0.36 1.15 0.00 0.00 0.00 179.25 179.90 1req h THR 258 N -0.54 1.03 -0.34 0.00 2.02 -1.66 -2.55 112.91 110.86 1req h THR 258 Ca 0.05 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 1req h THR 258 Cb 0.62 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1req h THR 258 CO -0.29 0.10 0.14 1.23 0.37 0.00 0.00 175.52 177.08 1req h GLY 259 N 0.57 0.55 0.55 2.16 0.00 -0.37 -2.86 103.07 103.66 1req h GLY 259 Ca 0.23 -0.29 0.02 0.00 0.00 0.00 0.00 47.33 47.28 1req h GLY 259 CO -0.06 0.28 -0.28 0.00 0.00 0.00 0.00 176.54 176.48 1req h ALA 260 N 0.99 -0.49 -0.89 3.60 0.00 -0.34 -1.76 119.26 120.37 1req h ALA 260 Ca 0.11 -0.05 0.20 0.00 0.00 0.00 0.00 54.91 55.17 1req h ALA 260 Cb 0.18 0.44 -0.11 0.00 0.00 0.00 0.00 17.79 18.29 1req h ALA 260 CO -0.01 -0.83 0.42 0.93 0.00 0.00 0.00 179.25 179.76 1req h GLU 261 N -0.51 0.46 0.00 0.00 4.39 -1.47 -0.35 114.58 117.10 1req h GLU 261 Ca 0.02 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1req h GLU 261 Cb 0.52 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1req h GLU 261 CO -0.14 0.31 -0.48 0.66 -1.16 0.00 0.00 179.01 178.19 1req n TYR 262 N -4.98 0.33 0.05 4.33 4.01 -1.08 -1.07 117.16 118.74 1req n TYR 262 Ca 0.21 0.10 -0.09 0.00 -0.16 0.00 0.00 57.90 57.95 1req n TYR 262 Cb 0.59 -0.52 -0.06 0.00 -0.31 0.00 0.00 39.34 39.04 1req n TYR 262 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1req h VAL 263 N 0.00 0.65 -0.44 -0.72 2.07 -0.32 -2.28 116.25 115.21 1req h VAL 263 Ca 0.00 -1.11 0.09 0.00 0.82 0.00 0.00 66.70 66.50 1req h VAL 263 Cb 0.64 1.12 -0.09 0.00 -1.52 0.00 0.00 31.29 31.44 1req h VAL 263 CO 0.00 0.18 -0.13 0.03 0.02 0.00 0.00 177.57 177.67 1req h ARG 264 N -0.94 -0.02 0.00 1.57 3.08 -1.16 -1.23 114.38 115.67 1req h ARG 264 Ca -0.02 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1req h ARG 264 Cb 0.47 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 1req h ARG 264 CO 0.04 -0.01 -0.09 0.00 -1.07 0.00 0.00 179.97 178.84 1req h ALA 265 N 1.40 1.23 0.00 0.04 0.00 -1.24 -0.93 119.26 119.75 1req h ALA 265 Ca 0.21 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 1req h ALA 265 Cb 0.35 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1req h ALA 265 CO -0.46 0.11 -1.00 -0.07 0.00 0.00 0.00 179.25 177.82 1req h LEU 266 N 0.00 0.00 -0.16 0.00 3.38 -0.65 -3.21 115.31 114.67 1req h LEU 266 Ca -0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.74 1req h LEU 266 Cb 0.30 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.06 1req h LEU 266 CO 0.01 0.68 -0.92 0.58 0.09 0.00 0.00 178.44 178.89 1req h VAL 267 N 0.00 1.34 -0.03 1.22 2.07 -0.54 -2.06 116.25 118.25 1req h VAL 267 Ca -0.08 -2.27 0.02 0.00 0.82 0.00 0.00 66.70 65.19 1req h VAL 267 Cb 1.59 2.30 -0.03 0.00 -1.52 0.00 0.00 31.29 33.63 1req h VAL 267 CO 0.08 0.69 -0.11 -0.33 0.02 0.00 0.00 177.57 177.92 1req h GLU 268 N 0.33 -0.16 -0.16 1.57 5.08 -1.33 -2.77 114.58 117.14 1req h GLU 268 Ca -0.08 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1req h GLU 268 Cb 1.55 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.83 1req h GLU 268 CO 0.17 -0.11 0.00 1.04 -1.00 0.00 0.00 179.01 179.11 1req n GLN 269 N -5.24 0.43 -0.29 2.33 6.02 -1.11 -4.77 117.38 114.75 1req n GLN 269 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.94 1req n GLN 269 Cb 0.16 -1.08 0.00 0.00 1.02 0.00 0.00 30.24 30.34 1req n GLN 269 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1req n GLY 270 N 0.06 0.88 3.69 1.08 0.00 -1.04 -4.96 105.19 104.90 1req n GLY 270 Ca 0.00 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 1req n GLY 270 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1req s PHE 271 N -2.00 2.81 0.00 1.61 0.08 -0.79 -5.02 117.98 114.66 1req s PHE 271 Ca 0.00 -0.19 0.00 0.00 0.12 0.00 0.00 56.93 56.86 1req s PHE 271 Cb 0.00 -1.25 0.00 0.00 -0.57 0.00 0.00 43.02 41.20 1req s PHE 271 CO 0.00 0.59 0.00 0.25 -0.10 0.00 0.00 175.22 175.96 1req n THR 272 N -0.98 0.00 0.07 0.64 -2.24 -1.26 -3.82 114.28 106.69 1req n THR 272 Ca -0.07 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.60 1req n THR 272 Cb 0.59 -1.83 -0.13 0.00 -2.10 0.00 0.00 70.33 66.86 1req n THR 272 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1req h ALA 273 N -2.00 0.29 -0.21 6.98 0.00 -1.90 -2.57 119.26 119.85 1req h ALA 273 Ca 0.00 -0.98 -0.00 0.00 0.00 0.00 0.00 54.91 53.93 1req h ALA 273 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1req h ALA 273 CO 0.00 1.17 0.13 1.15 0.00 0.00 0.00 179.25 181.70 1req h THR 274 N 0.03 1.08 0.00 0.00 2.02 -1.86 -0.38 112.91 113.80 1req h THR 274 Ca -0.11 -0.20 -0.08 0.00 0.77 0.00 0.00 66.41 66.79 1req h THR 274 Cb 1.89 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 69.12 1req h THR 274 CO 0.15 0.08 -0.37 -0.33 0.37 0.00 0.00 175.52 175.42 1req h GLU 275 N 0.26 0.00 0.08 6.66 5.08 -1.93 -0.15 114.58 124.58 1req h GLU 275 Ca 0.08 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1req h GLU 275 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1req h GLU 275 CO -0.01 0.37 -0.04 0.00 -1.00 0.00 0.00 179.01 178.33 1req h ALA 276 N 1.63 -0.10 -0.88 3.43 0.00 -1.22 -3.08 119.26 119.04 1req h ALA 276 Ca -0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1req h ALA 276 Cb 0.99 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 1req h ALA 276 CO 0.05 -0.40 0.54 0.74 0.00 0.00 0.00 179.25 180.18 1req h PHE 277 N -0.41 1.15 0.00 0.00 -1.00 -1.01 -2.48 116.94 113.19 1req h PHE 277 Ca -0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1req h PHE 277 Cb 0.36 -0.38 0.00 0.00 3.61 0.00 0.00 35.95 39.54 1req h PHE 277 CO 0.03 0.76 0.00 -0.25 -1.61 0.00 0.00 178.31 177.23 1req n ASP 278 N -4.42 0.09 -0.22 2.17 9.92 -0.07 -3.29 116.55 120.73 1req n ASP 278 Ca 0.09 0.53 0.03 0.00 -0.53 0.00 0.00 54.79 54.91 1req n ASP 278 Cb 0.05 -0.55 0.02 0.00 -0.64 0.00 0.00 41.12 40.00 1req n ASP 278 CO 0.00 0.00 0.00 1.07 0.13 0.00 0.00 177.20 178.40 1req n THR 279 N -1.61 0.00 -3.65 -3.53 5.66 -0.94 -4.89 114.28 105.32 1req n THR 279 Ca 0.02 -0.49 -0.36 0.00 -3.05 0.00 0.00 64.05 60.18 1req n THR 279 Cb 0.12 1.11 -0.07 0.00 -1.55 0.00 0.00 70.33 69.94 1req n THR 279 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1req s ILE 280 N -0.61 5.36 0.25 1.09 1.01 -1.20 -0.53 121.20 126.57 1req s ILE 280 Ca 0.07 0.37 0.06 0.00 0.00 0.00 0.00 60.65 61.14 1req s ILE 280 Cb 0.05 -3.54 -0.05 0.00 0.01 0.00 0.00 42.46 38.92 1req s ILE 280 CO 0.09 0.43 -0.05 0.20 0.00 0.00 0.00 174.94 175.62 1req s ASN 281 N 0.27 2.40 -0.08 3.58 -0.87 0.86 -4.70 114.94 116.41 1req s ASN 281 Ca 0.13 -1.19 0.04 0.00 -1.57 0.00 0.00 52.86 50.27 1req s ASN 281 Cb -0.12 -0.10 0.00 0.00 -0.02 0.00 0.00 41.25 41.01 1req s ASN 281 CO 0.01 -0.39 -0.21 -0.36 -2.57 0.00 0.00 177.10 173.58 1req s PHE 282 N -3.16 2.20 -0.39 2.20 0.40 0.14 -0.37 117.98 119.01 1req s PHE 282 Ca 0.28 -0.83 -0.16 0.00 -0.60 0.00 0.00 56.93 55.62 1req s PHE 282 Cb 0.04 -1.49 0.01 0.00 0.51 0.00 0.00 43.02 42.09 1req s PHE 282 CO 0.10 -0.33 0.41 0.50 0.70 0.00 0.00 175.22 176.60 1req s ARG 283 N 0.31 3.30 0.21 0.44 3.52 -0.74 0.17 118.95 126.16 1req s ARG 283 Ca -0.14 -0.60 0.11 0.00 -0.13 0.00 0.00 55.73 54.96 1req s ARG 283 Cb -0.16 -3.90 -0.05 0.00 -1.56 0.00 0.00 34.95 29.29 1req s ARG 283 CO 0.06 -0.71 -0.21 0.14 -0.81 0.00 0.00 175.30 173.77 1req s VAL 284 N 2.09 2.24 0.26 7.11 -7.23 0.43 -1.56 120.40 123.74 1req s VAL 284 Ca 0.12 -2.13 -0.26 0.00 -1.81 0.00 0.00 61.98 57.91 1req s VAL 284 Cb -0.17 -2.11 -0.09 0.00 0.56 0.00 0.00 36.38 34.57 1req s VAL 284 CO 0.13 -0.27 0.87 -0.89 -0.31 0.00 0.00 175.10 174.63 1req s THR 285 N -2.07 4.27 -0.31 5.32 2.01 -1.26 -0.89 115.64 122.71 1req s THR 285 Ca 0.22 1.76 -0.05 0.00 0.31 0.00 0.00 61.69 63.94 1req s THR 285 Cb -0.06 -4.07 0.03 0.00 0.01 0.00 0.00 72.50 68.41 1req s THR 285 CO 0.10 0.29 0.05 0.00 -0.69 0.00 0.00 174.62 174.38 1req s ALA 286 N -1.43 2.96 0.03 7.40 0.00 0.36 -4.84 121.76 126.24 1req s ALA 286 Ca 0.44 -1.64 0.00 0.00 0.00 0.00 0.00 51.96 50.76 1req s ALA 286 Cb -0.21 -2.10 0.00 0.00 0.00 0.00 0.00 23.12 20.82 1req s ALA 286 CO 0.25 -1.16 0.00 0.25 0.00 0.00 0.00 175.76 175.11 1req n THR 287 N 4.77 0.00 0.31 0.00 -2.24 -1.26 -0.91 114.28 114.94 1req n THR 287 Ca -0.14 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.76 1req n THR 287 Cb 0.45 -1.03 0.16 0.00 -2.10 0.00 0.00 70.33 67.82 1req n THR 287 CO 0.00 0.00 0.00 1.12 -0.57 0.00 0.00 175.07 175.62 1req h HIS 288 N -0.01 0.00 -2.44 4.78 2.07 -1.94 -3.33 115.15 114.28 1req h HIS 288 Ca 0.00 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.99 1req h HIS 288 Cb 0.00 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 29.92 1req h HIS 288 CO 0.00 0.00 1.13 0.34 -3.07 0.00 0.00 177.93 176.33 1req s ASP 289 N -5.40 5.98 0.09 3.10 -1.08 -1.26 -4.86 116.67 113.23 1req s ASP 289 Ca 0.05 -0.07 -0.35 0.00 -0.52 0.00 0.00 52.55 51.67 1req s ASP 289 Cb 0.09 -2.55 -0.16 0.00 -1.46 0.00 0.00 42.92 38.83 1req s ASP 289 CO 0.70 -1.90 1.55 -0.61 0.52 0.00 0.00 175.17 175.42 1req h GLN 290 N 11.32 -0.90 0.00 4.34 4.15 -1.89 -1.18 115.11 130.94 1req h GLN 290 Ca -0.27 0.06 -0.10 0.00 0.77 0.00 0.00 58.65 59.11 1req h GLN 290 Cb 1.08 0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.97 1req h GLN 290 CO 1.24 -0.60 -0.45 0.74 -1.93 0.00 0.00 178.83 177.82 1req h PHE 291 N -0.93 0.00 -0.12 3.99 0.04 -1.97 -1.79 116.94 116.15 1req h PHE 291 Ca -0.05 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.67 1req h PHE 291 Cb 0.83 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.98 1req h PHE 291 CO -0.30 0.45 -0.12 -0.07 -0.60 0.00 0.00 178.31 177.67 1req h LEU 292 N 0.00 0.31 0.05 1.54 3.38 -1.99 -2.56 115.31 116.04 1req h LEU 292 Ca -0.00 -0.48 0.02 0.00 0.09 0.00 0.00 57.88 57.51 1req h LEU 292 Cb 1.34 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.95 1req h LEU 292 CO 0.06 0.73 -0.48 0.74 0.09 0.00 0.00 178.44 179.58 1req h THR 293 N -0.10 0.07 -0.12 0.22 2.02 -1.16 0.10 112.91 113.94 1req h THR 293 Ca 0.02 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.24 1req h THR 293 Cb 0.64 0.07 -0.06 0.00 -1.74 0.00 0.00 68.15 67.06 1req h THR 293 CO 0.03 0.00 -0.31 0.40 0.37 0.00 0.00 175.52 176.01 1req h ILE 294 N -0.66 0.31 -0.36 3.11 2.04 -1.35 -2.00 117.51 118.59 1req h ILE 294 Ca 0.02 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.95 1req h ILE 294 Cb 0.71 0.31 -0.06 0.00 -0.74 0.00 0.00 36.82 37.03 1req h ILE 294 CO -0.31 0.00 -0.00 0.00 0.00 0.00 0.00 178.15 177.84 1req h ALA 295 N 0.43 0.32 -0.46 1.87 0.00 -1.29 -2.26 119.26 117.88 1req h ALA 295 Ca 0.09 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1req h ALA 295 Cb 0.54 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1req h ALA 295 CO -0.34 -0.40 0.27 -0.09 0.00 0.00 0.00 179.25 178.69 1req h ARG 296 N 0.09 0.53 0.00 0.00 2.43 -0.38 0.34 114.38 117.39 1req h ARG 296 Ca 0.18 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.27 1req h ARG 296 Cb 0.25 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1req h ARG 296 CO -0.30 0.35 -0.20 -0.07 -1.51 0.00 0.00 179.97 178.24 1req h LEU 297 N 0.54 0.00 0.16 3.80 3.38 -1.06 -2.05 115.31 120.08 1req h LEU 297 Ca 0.19 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.85 1req h LEU 297 Cb 0.02 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.80 1req h LEU 297 CO -0.09 0.20 -1.33 0.03 0.09 0.00 0.00 178.44 177.35 1req h ARG 298 N 0.00 0.53 -0.68 1.13 3.08 -0.97 -3.32 114.38 114.15 1req h ARG 298 Ca -0.00 -0.80 -0.05 0.00 0.07 0.00 0.00 59.98 59.20 1req h ARG 298 Cb 0.83 0.28 -0.03 0.00 0.08 0.00 0.00 29.97 31.13 1req h ARG 298 CO 0.03 1.37 0.23 0.00 -1.07 0.00 0.00 179.97 180.53 1req h ALA 299 N 0.31 0.89 0.03 0.04 0.00 -0.28 -2.58 119.26 117.66 1req h ALA 299 Ca -0.20 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.52 1req h ALA 299 Cb 2.01 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 19.49 1req h ALA 299 CO 0.25 0.55 -0.49 1.25 0.00 0.00 0.00 179.25 180.81 1req h LEU 300 N 0.98 -1.50 -0.65 0.00 6.46 -1.48 -1.05 115.31 118.08 1req h LEU 300 Ca 0.22 0.16 0.13 0.00 -0.12 0.00 0.00 57.88 58.28 1req h LEU 300 Cb 0.27 0.56 -0.12 0.00 -0.73 0.00 0.00 40.66 40.64 1req h LEU 300 CO -0.01 -0.49 -0.16 0.03 -0.62 0.00 0.00 178.44 177.20 1req h ARG 301 N -0.64 0.00 -0.56 1.25 3.08 -1.64 0.32 114.38 116.20 1req h ARG 301 Ca 0.01 -0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.14 1req h ARG 301 Cb 0.67 -0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.65 1req h ARG 301 CO -0.31 0.00 0.17 1.49 -1.07 0.00 0.00 179.97 180.25 1req h GLU 302 N 0.00 0.32 -0.09 0.04 4.81 -0.94 -1.52 114.58 117.20 1req h GLU 302 Ca 0.31 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.41 1req h GLU 302 Cb 0.48 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1req h GLU 302 CO -0.67 0.21 -0.38 0.00 -0.73 0.00 0.00 179.01 177.45 1req h ALA 303 N 1.40 0.16 -0.35 2.92 0.00 -0.27 -3.27 119.26 119.85 1req h ALA 303 Ca 0.28 -0.46 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1req h ALA 303 Cb 0.36 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1req h ALA 303 CO -0.31 0.26 0.21 2.35 0.00 0.00 0.00 179.25 181.76 1req h TRP 304 N -0.04 0.40 -0.63 0.00 -0.00 -0.15 -2.39 115.95 113.14 1req h TRP 304 Ca -0.02 0.01 0.13 0.00 -0.00 0.00 0.00 58.89 59.01 1req h TRP 304 Cb 1.02 -0.13 -0.11 0.00 -0.00 0.00 0.00 29.16 29.94 1req h TRP 304 CO 0.12 0.24 -0.05 0.00 -0.00 0.00 0.00 178.44 178.75 1req h ALA 305 N 1.15 0.56 -0.66 2.65 0.00 -1.27 -1.25 119.26 120.43 1req h ALA 305 Ca 0.14 0.21 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 1req h ALA 305 Cb -0.01 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1req h ALA 305 CO -0.06 -0.41 0.25 -0.09 0.00 0.00 0.00 179.25 178.94 1req h ARG 306 N 0.07 0.98 0.37 0.00 9.65 -1.56 -2.26 114.38 121.64 1req h ARG 306 Ca 0.32 -0.17 -0.00 0.00 -1.10 0.00 0.00 59.98 59.03 1req h ARG 306 Cb 0.52 -0.16 -0.03 0.00 -1.39 0.00 0.00 29.97 28.91 1req h ARG 306 CO -0.58 0.81 -0.51 0.82 2.80 0.00 0.00 179.97 183.32 1req h ILE 307 N 0.96 0.02 -1.01 1.20 2.04 -0.74 -2.80 117.51 117.18 1req h ILE 307 Ca 0.22 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.38 1req h ILE 307 Cb 0.21 0.02 -0.14 0.00 -0.74 0.00 0.00 36.82 36.17 1req h ILE 307 CO -0.02 0.00 0.59 1.23 0.00 0.00 0.00 178.15 179.95 1req h GLY 308 N -0.92 1.99 0.92 5.37 0.00 -0.83 -0.79 103.07 108.82 1req h GLY 308 Ca -0.04 -0.26 -0.04 0.00 0.00 0.00 0.00 47.33 46.99 1req h GLY 308 CO -0.14 -0.41 0.08 -2.09 0.00 0.00 0.00 176.54 173.98 1req h GLU 309 N 0.40 0.60 -0.27 4.80 4.81 -1.46 0.20 114.58 123.66 1req h GLU 309 Ca 0.71 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.70 1req h GLU 309 Cb 1.56 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.86 1req h GLU 309 CO -0.56 0.65 -0.17 0.28 -0.73 0.00 0.00 179.01 178.49 1req h VAL 310 N 0.45 1.30 0.00 0.32 2.07 -0.91 -3.10 116.25 116.38 1req h VAL 310 Ca 0.11 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.35 1req h VAL 310 Cb 0.33 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1req h VAL 310 CO 0.00 0.40 0.00 0.49 0.02 0.00 0.00 177.57 178.49 1req n PHE 311 N -4.41 0.00 -1.88 1.57 3.72 -0.56 -4.93 117.46 110.98 1req n PHE 311 Ca -0.04 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.23 1req n PHE 311 Cb 0.39 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.83 1req n PHE 311 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1req n GLY 312 N 0.46 0.52 3.73 1.37 0.00 -0.56 -4.67 105.19 106.04 1req n GLY 312 Ca 0.16 -0.35 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 1req n GLY 312 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1req s VAL 313 N -2.60 2.36 0.30 1.61 1.01 0.58 -4.78 120.40 118.87 1req s VAL 313 Ca 0.00 0.20 -0.28 0.00 0.00 0.00 0.00 61.98 61.90 1req s VAL 313 Cb 0.00 -2.90 -0.14 0.00 0.00 0.00 0.00 36.38 33.34 1req s VAL 313 CO 0.00 -0.07 0.98 0.47 0.00 0.00 0.00 175.10 176.48 1req n ASP 314 N -2.27 1.18 0.28 3.32 9.92 -1.26 -4.76 116.55 122.96 1req n ASP 314 Ca 0.14 1.16 0.15 0.00 -0.53 0.00 0.00 54.79 55.72 1req n ASP 314 Cb 0.50 -1.28 0.79 0.00 -0.64 0.00 0.00 41.12 40.49 1req n ASP 314 CO 0.00 0.00 0.00 1.05 0.13 0.00 0.00 177.20 178.38 1req h GLU 315 N 1.90 0.00 -0.01 -1.24 4.11 -1.94 -0.91 114.58 116.50 1req h GLU 315 Ca -0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.04 1req h GLU 315 Cb 1.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1req h GLU 315 CO 0.60 0.08 -0.09 -0.40 0.07 0.00 0.00 179.01 179.27 1req n ASP 316 N -3.39 0.71 -0.02 3.06 5.75 -1.26 -3.77 116.55 117.63 1req n ASP 316 Ca -0.01 -0.89 0.02 0.00 -0.01 0.00 0.00 54.79 53.91 1req n ASP 316 Cb 0.24 -0.02 0.03 0.00 -1.03 0.00 0.00 41.12 40.34 1req n ASP 316 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1req n LYS 317 N -0.67 2.51 0.00 0.11 5.02 -0.35 -4.70 118.16 120.09 1req n LYS 317 Ca 0.16 -1.74 0.15 0.00 -2.02 0.00 0.00 58.31 54.86 1req n LYS 317 Cb 0.28 -1.11 0.75 0.00 -0.02 0.00 0.00 35.03 34.93 1req n LYS 317 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1req n ARG 318 N -0.72 0.50 -2.75 1.97 1.74 -1.18 -4.81 116.66 111.41 1req n ARG 318 Ca 0.04 -0.04 -0.42 0.00 -0.77 0.00 0.00 57.85 56.67 1req n ARG 318 Cb 0.35 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.26 1req n ARG 318 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1req s GLY 319 N -2.52 2.76 0.56 -0.13 0.00 -1.26 -3.31 107.32 103.42 1req s GLY 319 Ca 0.30 0.45 -0.20 0.00 0.00 0.00 0.00 44.72 45.26 1req s GLY 319 CO 0.46 1.66 1.23 0.00 0.00 0.00 0.00 173.10 176.45 1req s ALA 320 N 1.18 2.69 -0.16 3.20 0.00 -1.26 -4.96 121.76 122.45 1req s ALA 320 Ca 0.49 1.05 -0.00 0.00 0.00 0.00 0.00 51.96 53.50 1req s ALA 320 Cb -0.20 -3.46 -0.00 0.00 0.00 0.00 0.00 23.12 19.46 1req s ALA 320 CO 0.25 -1.09 -0.14 1.03 0.00 0.00 0.00 175.76 175.80 1req s ARG 321 N -3.12 3.24 -0.09 0.00 0.52 -1.26 -4.62 118.95 113.61 1req s ARG 321 Ca 0.73 -0.73 0.03 0.00 -0.52 0.00 0.00 55.73 55.24 1req s ARG 321 Cb -0.32 -2.66 0.01 0.00 0.52 0.00 0.00 34.95 32.50 1req s ARG 321 CO 0.36 0.01 -0.19 -0.65 0.02 0.00 0.00 175.30 174.85 1req s GLN 322 N 0.84 2.51 -0.44 3.54 -0.21 -1.26 -0.69 119.66 123.96 1req s GLN 322 Ca -0.04 -0.69 -0.08 0.00 0.02 0.00 0.00 55.36 54.57 1req s GLN 322 Cb -0.15 -1.97 0.10 0.00 1.00 0.00 0.00 33.01 31.99 1req s GLN 322 CO -0.00 0.08 0.28 -0.80 -2.12 0.00 0.00 175.29 172.73 1req s ASN 323 N 0.56 5.57 0.06 5.90 0.01 0.13 -0.39 114.94 126.78 1req s ASN 323 Ca -0.15 -1.82 -0.24 0.00 -0.71 0.00 0.00 52.86 49.94 1req s ASN 323 Cb -0.17 -1.96 -0.06 0.00 0.41 0.00 0.00 41.25 39.48 1req s ASN 323 CO 0.05 -0.61 0.75 0.00 -1.51 0.00 0.00 177.10 175.78 1req s ALA 324 N 1.33 3.40 -0.03 0.60 0.00 0.02 -0.43 121.76 126.65 1req s ALA 324 Ca 0.05 0.26 0.05 0.00 0.00 0.00 0.00 51.96 52.33 1req s ALA 324 Cb -0.24 -2.95 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 1req s ALA 324 CO -0.01 0.12 -0.19 -1.50 0.00 0.00 0.00 175.76 174.19 1req s ILE 325 N -0.29 1.52 0.69 0.00 2.07 -0.07 -1.26 121.20 123.87 1req s ILE 325 Ca 0.37 -0.80 -0.12 0.00 -1.41 0.00 0.00 60.65 58.69 1req s ILE 325 Cb -0.21 -1.28 0.01 0.00 0.13 0.00 0.00 42.46 41.12 1req s ILE 325 CO 0.23 0.43 1.08 0.42 -1.91 0.00 0.00 174.94 175.19 1req s THR 326 N -0.27 3.64 0.12 4.00 -4.23 -0.95 -0.48 115.64 117.46 1req s THR 326 Ca 0.03 0.62 -0.31 0.00 -1.18 0.00 0.00 61.69 60.85 1req s THR 326 Cb -0.09 -3.20 -0.10 0.00 1.34 0.00 0.00 72.50 70.45 1req s THR 326 CO 0.00 -0.61 1.72 -0.55 -0.54 0.00 0.00 174.62 174.65 1req s SER 327 N -3.25 6.50 -0.02 3.99 0.15 -0.09 -4.71 113.70 116.26 1req s SER 327 Ca 0.62 2.67 -0.05 0.00 0.70 0.00 0.00 55.95 59.88 1req s SER 327 Cb -0.16 -2.57 -0.28 0.00 -1.71 0.00 0.00 66.02 61.29 1req s SER 327 CO 0.49 -0.94 0.77 -0.25 1.20 0.00 0.00 173.24 174.51 1req h TRP 328 N 8.04 0.53 -0.70 3.44 7.01 -1.92 -3.32 115.95 129.02 1req h TRP 328 Ca -0.44 -0.38 -0.00 0.00 2.11 0.00 0.00 58.89 60.17 1req h TRP 328 Cb 1.21 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 28.21 1req h TRP 328 CO 0.75 1.48 0.44 -0.09 -2.79 0.00 0.00 178.44 178.23 1req h ARG 329 N 0.08 0.94 0.00 2.65 2.43 -1.90 -2.54 114.38 116.03 1req h ARG 329 Ca -0.29 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.81 1req h ARG 329 Cb 2.05 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 31.39 1req h ARG 329 CO 0.16 0.65 0.00 0.39 -1.51 0.00 0.00 179.97 179.66 1req n GLU 330 N -4.41 0.92 -2.80 0.20 1.02 -1.25 -1.69 120.64 112.63 1req n GLU 330 Ca 0.07 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.87 1req n GLU 330 Cb 0.06 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 29.91 1req n GLU 330 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1req s LEU 331 N -2.07 4.06 0.23 -4.62 1.43 -0.96 -4.97 118.68 111.78 1req s LEU 331 Ca 0.45 1.74 0.11 0.00 -1.03 0.00 0.00 54.13 55.40 1req s LEU 331 Cb 0.21 -4.38 -0.05 0.00 0.03 0.00 0.00 46.19 42.01 1req s LEU 331 CO 0.37 -0.27 -0.18 0.42 0.23 0.00 0.00 176.35 176.92 1req s THR 332 N -2.00 2.65 -0.16 5.49 -4.23 -1.26 -4.62 115.64 111.50 1req s THR 332 Ca 0.58 -2.09 -0.18 0.00 -1.18 0.00 0.00 61.69 58.82 1req s THR 332 Cb -0.12 -2.33 -0.23 0.00 1.34 0.00 0.00 72.50 71.16 1req s THR 332 CO 0.16 -0.24 0.36 -0.09 -0.54 0.00 0.00 174.62 174.27 1req h ARG 333 N 2.69 0.10 -6.78 3.99 2.43 -1.95 -3.42 114.38 111.44 1req h ARG 333 Ca -0.44 -0.18 -0.48 0.00 -0.81 0.00 0.00 59.98 58.07 1req h ARG 333 Cb 1.23 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.83 1req h ARG 333 CO 0.54 1.09 0.34 -1.21 -1.51 0.00 0.00 179.97 179.22 1req s GLU 334 N -2.41 4.75 -0.81 0.20 8.01 -1.26 -3.99 118.70 123.18 1req s GLU 334 Ca -0.25 1.42 -0.02 0.00 0.01 0.00 0.00 54.97 56.13 1req s GLU 334 Cb 0.05 -3.12 -0.00 0.00 -4.31 0.00 0.00 34.13 26.75 1req s GLU 334 CO 0.67 0.44 0.66 -3.47 0.01 0.00 0.00 175.26 173.57 1req n ASP 335 N 1.18 -6.16 0.14 -0.19 -0.08 -1.26 -4.86 116.55 105.32 1req n ASP 335 Ca -0.01 -0.59 0.13 0.00 -1.51 0.00 0.00 54.79 52.81 1req n ASP 335 Cb 0.48 -3.36 0.32 0.00 2.34 0.00 0.00 41.12 40.90 1req n ASP 335 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1req h PRO 336 N -0.09 0.00 -0.03 -0.67 0.13 -1.71 -2.21 132.00 127.41 1req h PRO 336 Ca -0.36 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.77 1req h PRO 336 Cb 1.23 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1req h PRO 336 CO 0.35 0.00 0.03 1.88 -0.23 0.00 0.00 178.00 180.03 1req h TYR 337 N 0.00 0.00 -0.50 1.56 -1.99 -1.87 -0.28 116.97 113.88 1req h TYR 337 Ca 0.00 0.00 0.10 0.00 2.00 0.00 0.00 58.73 60.83 1req h TYR 337 Cb 0.82 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.52 1req h TYR 337 CO 0.00 0.00 0.34 0.28 -0.00 0.00 0.00 178.16 178.78 1req h VAL 338 N 0.00 0.86 0.00 -2.88 2.07 -1.75 -2.61 116.25 111.94 1req h VAL 338 Ca 0.02 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1req h VAL 338 Cb 0.08 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1req h VAL 338 CO -0.00 0.04 0.00 0.78 0.02 0.00 0.00 177.57 178.41 1req h ASN 339 N 0.24 0.00 -0.42 0.57 2.35 -1.24 -1.75 115.58 115.33 1req h ASN 339 Ca 0.23 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 56.00 1req h ASN 339 Cb 0.61 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.96 1req h ASN 339 CO -0.05 0.00 0.25 0.40 -1.65 0.00 0.00 177.43 176.38 1req h ILE 340 N 0.00 1.04 -0.31 2.81 2.04 -1.62 -0.52 117.51 120.95 1req h ILE 340 Ca 0.00 -0.17 -0.05 0.00 1.00 0.00 0.00 64.86 65.63 1req h ILE 340 Cb 0.11 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 1req h ILE 340 CO 0.00 0.09 -0.02 -0.07 0.00 0.00 0.00 178.15 178.15 1req h LEU 341 N 0.50 0.55 -0.60 1.44 3.38 -1.49 -1.15 115.31 117.93 1req h LEU 341 Ca 0.17 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.84 1req h LEU 341 Cb 0.01 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 1req h LEU 341 CO -0.08 0.74 0.37 0.03 0.09 0.00 0.00 178.44 179.59 1req h ARG 342 N 0.35 0.71 -0.16 1.13 3.08 -1.15 -2.13 114.38 116.21 1req h ARG 342 Ca 0.09 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.98 1req h ARG 342 Cb 0.47 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1req h ARG 342 CO 0.02 0.47 -0.39 0.78 -1.07 0.00 0.00 179.97 179.78 1req h GLY 343 N 0.73 0.38 0.99 0.04 0.00 -1.08 -2.83 103.07 101.29 1req h GLY 343 Ca 0.24 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.20 1req h GLY 343 CO -0.10 0.32 -0.17 1.76 0.00 0.00 0.00 176.54 178.35 1req h SER 344 N 0.29 -0.41 0.02 0.19 0.02 -0.85 -0.42 113.55 112.40 1req h SER 344 Ca 0.03 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.86 1req h SER 344 Cb 0.82 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.45 1req h SER 344 CO 0.07 -0.28 -0.39 -0.29 -1.14 0.00 0.00 176.83 174.80 1req h ILE 345 N -0.50 1.30 -0.25 3.27 2.10 -1.32 -2.45 117.51 119.65 1req h ILE 345 Ca -0.05 -1.53 -0.04 0.00 1.08 0.00 0.00 64.86 64.33 1req h ILE 345 Cb 0.38 1.56 -0.01 0.00 -1.09 0.00 0.00 36.82 37.66 1req h ILE 345 CO 0.08 0.48 0.01 0.00 -1.08 0.00 0.00 178.15 177.63 1req h ALA 346 N 1.19 0.34 -0.80 0.18 0.00 -1.47 -2.00 119.26 116.70 1req h ALA 346 Ca 0.04 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 1req h ALA 346 Cb 0.86 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1req h ALA 346 CO 0.07 0.07 0.37 1.15 0.00 0.00 0.00 179.25 180.91 1req h THR 347 N 0.23 1.25 0.01 0.00 2.02 -1.03 -2.39 112.91 113.00 1req h THR 347 Ca 0.07 -0.73 -0.00 0.00 0.77 0.00 0.00 66.41 66.52 1req h THR 347 Cb 0.40 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1req h THR 347 CO 0.01 0.31 -0.01 0.15 0.37 0.00 0.00 175.52 176.36 1req h PHE 348 N 1.15 -0.01 -0.37 3.16 3.04 -1.40 -2.70 116.94 119.80 1req h PHE 348 Ca 0.27 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 62.21 1req h PHE 348 Cb 0.14 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.63 1req h PHE 348 CO 0.02 0.01 0.16 0.77 -2.02 0.00 0.00 178.31 177.24 1req h SER 349 N -0.04 0.46 -0.29 0.41 0.02 -0.93 -1.64 113.55 111.55 1req h SER 349 Ca -0.00 -0.04 -0.14 0.00 -0.84 0.00 0.00 61.79 60.77 1req h SER 349 Cb 0.03 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.45 1req h SER 349 CO 0.00 0.42 -0.36 0.00 -1.14 0.00 0.00 176.83 175.75 1req h ALA 350 N 1.66 0.44 -0.25 3.77 0.00 -1.41 0.10 119.26 123.57 1req h ALA 350 Ca 0.13 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 1req h ALA 350 Cb 0.09 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1req h ALA 350 CO -0.01 0.51 -0.27 1.03 0.00 0.00 0.00 179.25 180.51 1req h SER 351 N 0.51 0.67 -0.26 0.00 0.87 -1.38 0.30 113.55 114.26 1req h SER 351 Ca 0.04 -0.48 -0.06 0.00 -1.23 0.00 0.00 61.79 60.05 1req h SER 351 Cb 0.95 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.70 1req h SER 351 CO 0.09 1.02 -0.02 0.58 -0.53 0.00 0.00 176.83 177.96 1req h VAL 352 N 0.33 1.22 0.00 2.23 2.07 -1.13 -2.70 116.25 118.27 1req h VAL 352 Ca 0.04 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.67 1req h VAL 352 Cb 0.84 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1req h VAL 352 CO 0.07 0.30 0.00 0.61 0.02 0.00 0.00 177.57 178.57 1req n GLY 353 N -0.77 -1.07 1.84 2.17 0.00 0.01 -4.59 105.19 102.79 1req n GLY 353 Ca 0.02 0.02 -0.03 0.00 0.00 0.00 0.00 46.02 46.02 1req n GLY 353 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1req n GLY 354 N -0.16 0.66 3.77 -0.02 0.00 -0.73 -4.18 105.19 104.53 1req n GLY 354 Ca 0.03 -0.58 -0.39 0.00 0.00 0.00 0.00 46.02 45.07 1req n GLY 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req s ALA 355 N -2.89 3.22 0.13 4.61 0.00 0.98 -4.75 121.76 123.06 1req s ALA 355 Ca 0.07 1.24 -0.11 0.00 0.00 0.00 0.00 51.96 53.16 1req s ALA 355 Cb -0.03 -3.49 -0.07 0.00 0.00 0.00 0.00 23.12 19.52 1req s ALA 355 CO 0.09 -0.87 1.42 0.93 0.00 0.00 0.00 175.76 177.33 1req h GLU 356 N 2.55 0.90 -4.88 0.00 3.07 -1.05 -3.45 114.58 111.72 1req h GLU 356 Ca -0.50 -0.55 -0.35 0.00 -0.50 0.00 0.00 59.36 57.47 1req h GLU 356 Cb 1.25 0.05 -0.23 0.00 -0.84 0.00 0.00 28.75 28.99 1req h GLU 356 CO 0.62 1.19 -0.76 -1.54 -1.40 0.00 0.00 179.01 177.12 1req s SER 357 N -6.93 1.20 -0.06 1.42 1.04 -0.79 -2.32 113.70 107.26 1req s SER 357 Ca -0.11 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 55.83 1req s SER 357 Cb 0.10 -0.03 0.02 0.00 0.10 0.00 0.00 66.02 66.22 1req s SER 357 CO 0.89 -0.09 -0.04 -0.63 0.98 0.00 0.00 173.24 174.34 1req s ILE 358 N -1.10 0.61 -0.20 -1.02 1.01 -0.17 -0.80 121.20 119.53 1req s ILE 358 Ca -0.04 -0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.47 1req s ILE 358 Cb -0.09 -0.67 -0.01 0.00 0.01 0.00 0.00 42.46 41.71 1req s ILE 358 CO 0.01 0.27 -0.06 -0.89 0.00 0.00 0.00 174.94 174.26 1req s THR 359 N 1.31 3.26 -0.24 2.92 2.01 -0.39 -2.00 115.64 122.52 1req s THR 359 Ca -0.04 -0.54 -0.12 0.00 0.31 0.00 0.00 61.69 61.30 1req s THR 359 Cb -0.14 -2.46 -0.05 0.00 0.01 0.00 0.00 72.50 69.86 1req s THR 359 CO -0.02 0.45 0.21 -0.89 -0.69 0.00 0.00 174.62 173.68 1req s THR 360 N 1.30 5.32 0.32 -0.82 2.01 -1.26 -2.25 115.64 120.25 1req s THR 360 Ca 0.04 0.28 -0.29 0.00 0.31 0.00 0.00 61.69 62.03 1req s THR 360 Cb -0.14 -3.55 -0.10 0.00 0.01 0.00 0.00 72.50 68.71 1req s THR 360 CO -0.03 0.30 1.31 -0.76 -0.69 0.00 0.00 174.62 174.76 1req s LEU 361 N 1.28 4.43 0.73 4.42 1.43 -1.26 -4.78 118.68 124.92 1req s LEU 361 Ca 0.10 2.67 -0.16 0.00 -1.03 0.00 0.00 54.13 55.71 1req s LEU 361 Cb -0.14 -3.65 0.03 0.00 0.03 0.00 0.00 46.19 42.46 1req s LEU 361 CO 0.06 -0.54 1.13 -2.65 0.23 0.00 0.00 176.35 174.59 1req n PRO 362 N 0.99 0.57 0.22 1.29 -0.02 -1.26 -4.82 135.00 131.96 1req n PRO 362 Ca 0.01 0.26 0.08 0.00 -2.02 0.00 0.00 63.50 61.83 1req n PRO 362 Cb 0.42 -2.37 0.49 0.00 -0.02 0.00 0.00 33.50 32.02 1req n PRO 362 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1req h PHE 363 N -0.25 0.00 0.00 6.00 -0.00 -1.87 -2.77 116.94 118.05 1req h PHE 363 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.49 1req h PHE 363 Cb 1.32 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.27 1req h PHE 363 CO 0.42 0.26 0.00 0.25 -0.00 0.00 0.00 178.31 179.24 1req n THR 364 N -3.63 0.00 0.28 0.88 -2.24 -1.26 -4.53 114.28 103.78 1req n THR 364 Ca -0.01 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 61.94 1req n THR 364 Cb 0.39 -0.55 0.69 0.00 -2.10 0.00 0.00 70.33 68.76 1req n THR 364 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1req h GLN 365 N 0.00 0.00 -0.00 -0.78 5.75 -1.66 0.04 115.11 118.47 1req h GLN 365 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1req h GLN 365 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1req h GLN 365 CO 0.00 0.01 -0.35 0.00 -2.65 0.00 0.00 178.83 175.84 1req n ALA 366 N -2.10 3.24 -0.09 3.38 0.00 -1.26 -4.30 120.51 119.37 1req n ALA 366 Ca 0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 53.44 53.01 1req n ALA 366 Cb 0.30 -1.18 -0.12 0.00 0.00 0.00 0.00 19.45 18.45 1req n ALA 366 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1req n LEU 367 N -1.26 1.27 0.00 0.00 4.77 -0.03 -4.85 117.00 116.89 1req n LEU 367 Ca 0.08 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1req n LEU 367 Cb 0.33 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1req n LEU 367 CO 0.31 0.60 0.00 0.61 -1.33 0.00 0.00 177.39 177.58 1req n GLY 368 N 2.20 -1.15 3.86 -0.72 0.00 -1.00 -4.66 105.19 103.72 1req n GLY 368 Ca -0.31 -1.25 -0.35 0.00 0.00 0.00 0.00 46.02 44.11 1req n GLY 368 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1req s LEU 369 N 0.00 4.33 0.50 0.99 1.43 0.15 -4.19 118.68 121.90 1req s LEU 369 Ca 0.00 0.87 -0.22 0.00 -1.03 0.00 0.00 54.13 53.75 1req s LEU 369 Cb 0.00 -3.12 -0.08 0.00 0.03 0.00 0.00 46.19 43.02 1req s LEU 369 CO 0.00 0.13 1.03 -2.65 0.23 0.00 0.00 176.35 175.09 1req n PRO 370 N 0.78 1.25 -0.03 1.29 -0.02 -1.26 -0.12 135.00 136.90 1req n PRO 370 Ca -0.06 0.46 0.11 0.00 -2.02 0.00 0.00 63.50 61.99 1req n PRO 370 Cb 0.52 -2.15 0.12 0.00 -0.02 0.00 0.00 33.50 31.97 1req n PRO 370 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1req n GLU 371 N -0.35 2.20 -0.76 -0.52 2.13 -1.26 -4.55 120.64 117.53 1req n GLU 371 Ca 0.11 -1.92 0.00 0.00 0.66 0.00 0.00 57.16 56.00 1req n GLU 371 Cb 0.43 -1.44 0.00 0.00 0.27 0.00 0.00 31.44 30.69 1req n GLU 371 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1req n ASP 372 N 1.30 0.00 0.21 4.31 5.68 -1.26 -5.03 116.55 121.76 1req n ASP 372 Ca 0.14 -0.58 0.10 0.00 -0.50 0.00 0.00 54.79 53.95 1req n ASP 372 Cb 0.57 0.00 0.25 0.00 -1.14 0.00 0.00 41.12 40.80 1req n ASP 372 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 1req h ASP 373 N 0.00 0.00 -0.81 -1.12 3.58 -2.01 -3.39 116.42 112.67 1req h ASP 373 Ca 0.00 0.00 0.07 0.00 0.42 0.00 0.00 57.03 57.52 1req h ASP 373 Cb 0.00 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 40.95 1req h ASP 373 CO 0.00 0.18 -0.48 0.33 -2.88 0.00 0.00 179.24 176.39 1req n PHE 374 N -3.18 -0.36 0.15 0.28 7.35 -1.26 0.39 117.46 120.83 1req n PHE 374 Ca 0.02 1.01 -0.00 0.00 -0.76 0.00 0.00 57.45 57.72 1req n PHE 374 Cb 0.54 -0.56 0.23 0.00 0.35 0.00 0.00 39.48 40.04 1req n PHE 374 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1req h PRO 375 N 0.00 0.03 -0.15 -7.13 0.11 -2.00 -0.54 132.00 122.32 1req h PRO 375 Ca 0.13 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.17 1req h PRO 375 Cb 0.33 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.44 1req h PRO 375 CO -0.76 0.55 -0.10 -0.07 -0.21 0.00 0.00 178.00 177.40 1req h LEU 376 N 0.02 0.35 -0.88 2.35 3.38 -1.53 -1.23 115.31 117.77 1req h LEU 376 Ca -0.00 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 1req h LEU 376 Cb 0.94 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 1req h LEU 376 CO 0.07 0.72 0.55 -0.09 0.09 0.00 0.00 178.44 179.78 1req h ARG 377 N -0.02 1.18 -0.44 1.13 2.43 0.60 0.21 114.38 119.48 1req h ARG 377 Ca 0.03 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 59.02 1req h ARG 377 Cb 0.60 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1req h ARG 377 CO 0.03 0.82 -0.05 0.82 -1.51 0.00 0.00 179.97 180.07 1req h ILE 378 N 1.21 1.27 0.19 1.20 1.08 -1.11 0.12 117.51 121.47 1req h ILE 378 Ca 0.32 -1.13 -0.00 0.00 -0.39 0.00 0.00 64.86 63.66 1req h ILE 378 Cb -0.08 1.10 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 1req h ILE 378 CO -0.06 0.39 -0.15 0.00 -0.69 0.00 0.00 178.15 177.63 1req h ALA 379 N 0.89 -0.33 -0.10 1.87 0.00 -0.70 -2.10 119.26 118.78 1req h ALA 379 Ca 0.12 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1req h ALA 379 Cb 0.57 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1req h ALA 379 CO 0.03 -0.70 -0.47 0.07 0.00 0.00 0.00 179.25 178.18 1req h ARG 380 N -0.35 0.26 0.00 0.00 0.11 -0.84 -3.08 114.38 110.48 1req h ARG 380 Ca -0.01 -0.14 -0.03 0.00 0.10 0.00 0.00 59.98 59.90 1req h ARG 380 Cb 0.32 0.01 -0.00 0.00 1.11 0.00 0.00 29.97 31.40 1req h ARG 380 CO -0.01 0.68 -0.14 -0.91 0.10 0.00 0.00 179.97 179.69 1req h ASN 381 N 0.21 0.00 -0.15 0.08 2.35 -0.92 -2.50 115.58 114.64 1req h ASN 381 Ca 0.01 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.80 1req h ASN 381 Cb 0.92 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.25 1req h ASN 381 CO 0.07 0.14 -0.06 0.74 -1.65 0.00 0.00 177.43 176.67 1req h THR 382 N 0.00 0.78 -0.31 2.81 2.02 -1.28 0.42 112.91 117.35 1req h THR 382 Ca -0.00 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.05 1req h THR 382 Cb 0.36 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1req h THR 382 CO 0.02 0.00 -0.30 1.23 0.37 0.00 0.00 175.52 176.84 1req h GLY 383 N -0.04 0.82 1.00 2.16 0.00 -1.60 -1.92 103.07 103.49 1req h GLY 383 Ca 0.08 -0.84 -0.01 0.00 0.00 0.00 0.00 47.33 46.56 1req h GLY 383 CO -0.18 0.76 0.35 -2.22 0.00 0.00 0.00 176.54 175.25 1req h ILE 384 N 0.52 1.20 -0.31 2.60 2.04 -1.18 0.27 117.51 122.66 1req h ILE 384 Ca 0.05 -0.52 -0.18 0.00 1.00 0.00 0.00 64.86 65.21 1req h ILE 384 Cb 0.88 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1req h ILE 384 CO 0.08 0.22 -0.53 0.58 0.00 0.00 0.00 178.15 178.50 1req h VAL 385 N 0.88 1.27 -0.68 1.67 2.07 -0.20 -0.36 116.25 120.91 1req h VAL 385 Ca 0.23 -1.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.03 1req h VAL 385 Cb 0.04 1.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 1req h VAL 385 CO -0.04 0.56 0.39 -0.07 0.02 0.00 0.00 177.57 178.43 1req h LEU 386 N 0.69 0.84 0.54 2.57 3.38 -0.87 0.24 115.31 122.70 1req h LEU 386 Ca 0.02 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1req h LEU 386 Cb 1.14 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 41.68 1req h LEU 386 CO 0.12 0.68 -0.26 0.00 0.09 0.00 0.00 178.44 179.07 1req h ALA 387 N 1.20 -1.00 0.00 1.53 0.00 -0.18 -2.92 119.26 117.89 1req h ALA 387 Ca 0.24 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1req h ALA 387 Cb 0.01 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1req h ALA 387 CO -0.04 -0.95 -0.70 0.93 0.00 0.00 0.00 179.25 178.49 1req h GLU 388 N -0.86 0.00 0.00 0.00 5.08 -1.04 -2.84 114.58 114.92 1req h GLU 388 Ca -0.07 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 1req h GLU 388 Cb 0.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1req h GLU 388 CO 0.12 0.32 -1.27 0.39 -1.00 0.00 0.00 179.01 177.57 1req n GLU 389 N -3.06 2.08 0.13 2.33 1.02 0.02 -4.63 120.64 118.53 1req n GLU 389 Ca -0.01 0.01 0.10 0.00 -0.02 0.00 0.00 57.16 57.24 1req n GLU 389 Cb 0.71 -1.10 0.04 0.00 -0.02 0.00 0.00 31.44 31.07 1req n GLU 389 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1req h VAL 390 N 0.00 0.11 -6.29 2.62 2.07 -1.46 -3.49 116.25 109.81 1req h VAL 390 Ca -0.10 -1.19 -0.47 0.00 0.82 0.00 0.00 66.70 65.75 1req h VAL 390 Cb 1.21 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.71 1req h VAL 390 CO -0.00 0.06 -0.76 0.59 0.02 0.00 0.00 177.57 177.48 1req n ASN 391 N -2.86 -4.58 0.17 0.57 4.13 -1.07 -4.89 115.26 106.73 1req n ASN 391 Ca 0.00 -0.78 0.11 0.00 1.68 0.00 0.00 54.58 55.59 1req n ASN 391 Cb 0.59 -3.90 0.09 0.00 -1.54 0.00 0.00 39.78 35.02 1req n ASN 391 CO 0.00 0.00 0.00 0.16 0.28 0.00 0.00 177.26 177.70 1req h ILE 392 N -2.08 0.04 -0.38 2.41 3.07 -1.68 -3.26 117.51 115.62 1req h ILE 392 Ca -0.58 -1.06 0.00 0.00 1.55 0.00 0.00 64.86 64.77 1req h ILE 392 Cb 1.38 1.81 0.00 0.00 -0.27 0.00 0.00 36.82 39.74 1req h ILE 392 CO 0.67 0.02 0.00 0.61 -1.05 0.00 0.00 178.15 178.40 1req n GLY 393 N 1.14 0.78 0.16 0.16 0.00 -1.26 -4.19 105.19 101.99 1req n GLY 393 Ca 0.02 -0.41 0.06 0.00 0.00 0.00 0.00 46.02 45.68 1req n GLY 393 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1req h ARG 394 N 2.23 0.00 -5.79 1.61 3.08 -1.76 -3.43 114.38 110.32 1req h ARG 394 Ca 0.00 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.38 1req h ARG 394 Cb 0.51 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 30.38 1req h ARG 394 CO 0.00 0.32 -0.65 0.08 -1.07 0.00 0.00 179.97 178.65 1req s VAL 395 N -3.05 4.08 -0.09 2.04 1.01 -1.26 -4.35 120.40 118.78 1req s VAL 395 Ca 0.05 -0.32 -0.27 0.00 0.00 0.00 0.00 61.98 61.44 1req s VAL 395 Cb 0.07 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1req s VAL 395 CO 0.73 0.56 0.86 0.20 0.00 0.00 0.00 175.10 177.45 1req s ASN 396 N -0.45 7.11 -0.90 3.32 0.01 -1.26 -4.42 114.94 118.35 1req s ASN 396 Ca 0.08 1.36 -0.07 0.00 -0.71 0.00 0.00 52.86 53.51 1req s ASN 396 Cb -0.12 -2.49 -0.00 0.00 0.41 0.00 0.00 41.25 39.05 1req s ASN 396 CO 0.02 -0.30 0.70 -0.67 -1.51 0.00 0.00 177.10 175.34 1req n ASP 397 N 4.49 -5.93 -0.30 -1.22 2.03 -1.26 -4.88 116.55 109.47 1req n ASP 397 Ca 0.04 -0.71 0.10 0.00 0.52 0.00 0.00 54.79 54.74 1req n ASP 397 Cb 0.50 -3.36 0.32 0.00 -0.72 0.00 0.00 41.12 37.86 1req n ASP 397 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1req h PRO 398 N -0.59 0.79 0.00 -0.67 0.11 -1.81 0.40 132.00 130.23 1req h PRO 398 Ca -0.45 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1req h PRO 398 Cb 1.26 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1req h PRO 398 CO 0.38 0.52 0.00 0.00 -0.21 0.00 0.00 178.00 178.70 1req n ALA 399 N -2.40 1.93 -1.45 -0.75 0.00 -1.26 -4.84 120.51 111.73 1req n ALA 399 Ca 0.17 -0.07 -0.54 0.00 0.00 0.00 0.00 53.44 53.00 1req n ALA 399 Cb 0.40 -1.32 -0.08 0.00 0.00 0.00 0.00 19.45 18.44 1req n ALA 399 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1req n GLY 400 N 0.57 0.41 0.00 0.00 0.00 0.14 -0.15 105.19 106.16 1req n GLY 400 Ca 0.05 0.98 0.00 0.00 0.00 0.00 0.00 46.02 47.05 1req n GLY 400 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1req n GLY 401 N 6.33 3.14 3.47 -0.02 0.00 -1.26 -5.04 105.19 111.81 1req n GLY 401 Ca 0.42 -1.05 -0.60 0.00 0.00 0.00 0.00 46.02 44.79 1req n GLY 401 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1req n SER 402 N 0.29 0.24 0.09 1.61 2.88 0.79 -4.86 113.62 114.67 1req n SER 402 Ca 0.00 1.14 -0.13 0.00 -1.33 0.00 0.00 58.87 58.55 1req n SER 402 Cb 0.00 -0.89 -0.07 0.00 -0.75 0.00 0.00 64.21 62.49 1req n SER 402 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 1req h TYR 403 N 3.34 -0.14 -0.08 0.66 0.05 -1.89 0.13 116.97 119.04 1req h TYR 403 Ca -0.48 -0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.33 1req h TYR 403 Cb 1.39 0.05 -0.06 0.00 1.01 0.00 0.00 36.73 39.11 1req h TYR 403 CO 0.57 -0.08 -0.47 -0.92 -1.05 0.00 0.00 178.16 176.21 1req h TYR 404 N -0.15 -1.35 -0.50 4.88 3.20 -1.89 0.83 116.97 121.98 1req h TYR 404 Ca -0.02 0.05 -0.10 0.00 3.14 0.00 0.00 58.73 61.80 1req h TYR 404 Cb 0.12 0.60 -0.02 0.00 1.54 0.00 0.00 36.73 38.98 1req h TYR 404 CO -0.07 -0.51 -0.09 0.28 -1.64 0.00 0.00 178.16 176.13 1req h VAL 405 N -0.56 1.27 -0.10 1.81 2.07 -1.82 0.12 116.25 119.03 1req h VAL 405 Ca 0.05 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.34 1req h VAL 405 Cb 0.66 1.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1req h VAL 405 CO -0.39 0.43 0.03 -0.33 0.02 0.00 0.00 177.57 177.33 1req h GLU 406 N 0.81 0.16 0.37 1.57 4.39 -0.72 0.13 114.58 121.30 1req h GLU 406 Ca 0.13 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 1req h GLU 406 Cb 0.64 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 1req h GLU 406 CO 0.04 0.33 -0.44 1.03 -1.16 0.00 0.00 179.01 178.81 1req h SER 407 N -0.04 -1.23 -0.83 1.42 0.87 -0.65 -2.50 113.55 110.59 1req h SER 407 Ca 0.03 0.11 0.17 0.00 -1.23 0.00 0.00 61.79 60.88 1req h SER 407 Cb 0.24 0.42 -0.11 0.00 -0.44 0.00 0.00 62.40 62.52 1req h SER 407 CO 0.00 -0.58 0.36 0.25 -0.53 0.00 0.00 176.83 176.33 1req h LEU 408 N -0.85 0.33 -0.09 2.23 5.85 -0.78 0.12 115.31 122.12 1req h LEU 408 Ca -0.03 0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.85 1req h LEU 408 Cb 0.77 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 1req h LEU 408 CO -0.11 0.08 -0.20 0.74 -0.34 0.00 0.00 178.44 178.61 1req h THR 409 N 0.45 0.51 -0.03 1.05 2.02 -0.50 -1.89 112.91 114.52 1req h THR 409 Ca 0.48 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.57 1req h THR 409 Cb 0.81 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1req h THR 409 CO -0.45 0.00 -0.42 -0.09 0.37 0.00 0.00 175.52 174.92 1req h ARG 410 N -0.27 0.07 -0.85 6.66 9.65 -0.92 -1.86 114.38 126.86 1req h ARG 410 Ca 0.09 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.93 1req h ARG 410 Cb 0.40 -0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.93 1req h ARG 410 CO -0.25 0.49 0.53 0.77 2.80 0.00 0.00 179.97 184.31 1req h SER 411 N 0.06 1.01 0.94 -3.80 0.02 -0.75 -2.24 113.55 108.79 1req h SER 411 Ca 0.00 -0.05 -0.22 0.00 -0.84 0.00 0.00 61.79 60.68 1req h SER 411 Cb 0.78 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 1req h SER 411 CO 0.06 0.76 -1.04 -0.07 -1.14 0.00 0.00 176.83 175.39 1req h LEU 412 N 1.16 0.07 0.13 5.07 3.38 -1.15 -2.25 115.31 121.73 1req h LEU 412 Ca 0.31 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1req h LEU 412 Cb -0.08 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1req h LEU 412 CO -0.06 1.06 -0.06 0.00 0.09 0.00 0.00 178.44 179.46 1req h ALA 413 N 0.93 -0.18 -0.82 1.53 0.00 -1.30 0.85 119.26 120.28 1req h ALA 413 Ca -0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1req h ALA 413 Cb 1.80 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.62 1req h ALA 413 CO 0.14 -0.50 0.42 -0.44 0.00 0.00 0.00 179.25 178.87 1req h ASP 414 N -0.37 1.04 -0.43 0.00 3.32 -1.47 0.58 116.42 119.09 1req h ASP 414 Ca -0.02 -0.12 -0.14 0.00 0.02 0.00 0.00 57.03 56.77 1req h ASP 414 Cb 0.30 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1req h ASP 414 CO 0.03 0.86 -0.28 0.00 -1.72 0.00 0.00 179.24 178.13 1req h ALA 415 N 1.22 0.62 0.04 3.45 0.00 -1.42 -2.18 119.26 120.99 1req h ALA 415 Ca 0.28 -0.42 -0.23 0.00 0.00 0.00 0.00 54.91 54.55 1req h ALA 415 Cb 0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1req h ALA 415 CO -0.04 0.65 -1.00 0.00 0.00 0.00 0.00 179.25 178.86 1req h ALA 416 N 0.82 0.36 0.35 0.00 0.00 0.23 -3.09 119.26 117.93 1req h ALA 416 Ca 0.09 -0.77 -0.00 0.00 0.00 0.00 0.00 54.91 54.22 1req h ALA 416 Cb 0.87 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1req h ALA 416 CO 0.08 0.93 -0.29 2.35 0.00 0.00 0.00 179.25 182.31 1req h TRP 417 N 0.12 -0.77 -0.47 0.00 2.91 0.09 -0.07 115.95 117.76 1req h TRP 417 Ca -0.07 0.00 0.14 0.00 1.13 0.00 0.00 58.89 60.08 1req h TRP 417 Cb 1.66 0.29 -0.02 0.00 -0.51 0.00 0.00 29.16 30.59 1req h TRP 417 CO 0.04 -0.43 0.36 -0.22 -1.03 0.00 0.00 178.44 177.16 1req h LYS 418 N -0.65 0.00 0.00 2.65 3.64 -1.44 0.36 116.57 121.12 1req h LYS 418 Ca -0.03 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.19 1req h LYS 418 Cb 0.57 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 1req h LYS 418 CO -0.02 0.00 -0.77 1.49 -2.27 0.00 0.00 179.45 177.87 1req h GLU 419 N 0.00 0.00 0.34 1.90 4.57 -1.41 -3.09 114.58 116.89 1req h GLU 419 Ca 0.22 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.39 1req h GLU 419 Cb 0.93 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.52 1req h GLU 419 CO -0.00 0.77 -0.17 0.35 -1.18 0.00 0.00 179.01 178.78 1req h PHE 420 N 0.00 -0.43 -0.60 0.92 3.57 0.16 -1.78 116.94 118.78 1req h PHE 420 Ca -0.01 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.54 1req h PHE 420 Cb 1.52 0.14 -0.09 0.00 2.79 0.00 0.00 35.95 40.31 1req h PHE 420 CO 0.00 -0.09 -0.48 1.96 -2.23 0.00 0.00 178.31 177.46 1req h GLN 421 N -0.91 -0.16 -0.67 1.11 4.20 -1.31 0.20 115.11 117.57 1req h GLN 421 Ca -0.05 0.01 0.18 0.00 0.06 0.00 0.00 58.65 58.86 1req h GLN 421 Cb 0.53 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 1req h GLN 421 CO 0.08 -0.11 0.47 1.49 -0.67 0.00 0.00 178.83 180.10 1req h GLU 422 N -0.16 0.06 -0.30 1.46 4.81 -1.52 -1.53 114.58 117.40 1req h GLU 422 Ca 0.10 -0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.17 1req h GLU 422 Cb 0.42 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1req h GLU 422 CO -0.65 0.04 -0.45 0.28 -0.73 0.00 0.00 179.01 177.50 1req h VAL 423 N 0.07 1.29 -0.07 0.32 2.07 -0.05 -3.18 116.25 116.69 1req h VAL 423 Ca 0.32 -1.64 -0.09 0.00 0.82 0.00 0.00 66.70 66.11 1req h VAL 423 Cb 1.18 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 1req h VAL 423 CO -0.02 0.53 -0.39 -0.33 0.02 0.00 0.00 177.57 177.38 1req h GLU 424 N 0.62 0.16 -0.00 1.57 4.39 -0.73 -0.70 114.58 119.89 1req h GLU 424 Ca 0.04 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1req h GLU 424 Cb 1.02 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.66 1req h GLU 424 CO 0.10 0.52 -0.04 1.17 -1.16 0.00 0.00 179.01 179.60 1req n LYS 425 N -4.05 0.58 0.00 2.33 3.00 -0.87 -1.71 118.16 117.43 1req n LYS 425 Ca -0.01 -0.08 0.11 0.00 -0.00 0.00 0.00 58.31 58.32 1req n LYS 425 Cb 0.45 -1.50 -0.01 0.00 0.00 0.00 0.00 35.03 33.97 1req n LYS 425 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1req n LEU 426 N -1.14 1.96 0.00 3.14 4.77 -1.16 -4.96 117.00 119.61 1req n LEU 426 Ca 0.15 -0.75 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 1req n LEU 426 Cb 0.24 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1req n LEU 426 CO 0.23 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1req n GLY 427 N 1.40 1.03 0.00 -0.72 0.00 -0.69 -4.75 105.19 101.46 1req n GLY 427 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1req n GLY 427 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1req n GLY 428 N -0.27 -1.35 0.07 -0.02 0.00 -0.28 -4.68 105.19 98.67 1req n GLY 428 Ca 0.00 -2.20 0.12 0.00 0.00 0.00 0.00 46.02 43.94 1req n GLY 428 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1req h MET 429 N 4.27 0.00 -0.17 1.61 4.05 -1.82 -2.73 114.93 120.14 1req h MET 429 Ca 0.00 0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 59.34 1req h MET 429 Cb 0.00 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 30.80 1req h MET 429 CO 0.00 0.00 -0.21 0.77 0.23 0.00 0.00 176.91 177.70 1req h SER 430 N 0.00 0.49 0.19 1.39 0.02 -1.94 -2.43 113.55 111.27 1req h SER 430 Ca 0.00 -0.50 0.01 0.00 -0.84 0.00 0.00 61.79 60.46 1req h SER 430 Cb 0.78 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.15 1req h SER 430 CO 0.00 0.89 -0.31 0.50 -1.14 0.00 0.00 176.83 176.77 1req h LYS 431 N 0.09 -0.55 -0.91 3.45 3.64 -1.83 -2.84 116.57 117.62 1req h LYS 431 Ca 0.02 0.04 0.20 0.00 -1.27 0.00 0.00 60.65 59.64 1req h LYS 431 Cb 0.77 0.13 -0.17 0.00 -0.41 0.00 0.00 32.23 32.55 1req h LYS 431 CO 0.05 -0.37 -0.15 0.00 -2.27 0.00 0.00 179.45 176.71 1req h ALA 432 N 0.05 0.73 0.76 5.00 0.00 -1.36 0.08 119.26 124.53 1req h ALA 432 Ca 0.01 0.34 -0.03 0.00 0.00 0.00 0.00 54.91 55.23 1req h ALA 432 Cb 0.57 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1req h ALA 432 CO -0.14 -0.43 -0.50 0.28 0.00 0.00 0.00 179.25 178.46 1req h VAL 433 N 0.01 0.00 -1.01 0.00 2.07 -1.21 -3.16 116.25 112.95 1req h VAL 433 Ca 0.47 0.00 0.13 0.00 0.82 0.00 0.00 66.70 68.12 1req h VAL 433 Cb 0.78 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.46 1req h VAL 433 CO -0.90 0.00 0.63 0.24 0.02 0.00 0.00 177.57 177.56 1req h MET 434 N -1.19 0.93 0.00 1.57 2.86 -0.87 -3.42 114.93 114.81 1req h MET 434 Ca -0.10 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1req h MET 434 Cb 0.96 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.41 1req h MET 434 CO 0.08 0.61 0.00 -2.37 1.06 0.00 0.00 176.91 176.30 1req n THR 435 N -4.64 0.00 -0.36 2.22 5.66 -0.16 -4.98 114.28 112.02 1req n THR 435 Ca 0.20 0.00 0.09 0.00 -3.05 0.00 0.00 64.05 61.29 1req n THR 435 Cb 0.40 -0.64 0.27 0.00 -1.55 0.00 0.00 70.33 68.80 1req n THR 435 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1req n GLU 436 N 0.00 2.91 0.13 1.09 -0.58 -1.26 -4.74 120.64 118.20 1req n GLU 436 Ca 0.00 -2.48 -0.05 0.00 -0.42 0.00 0.00 57.16 54.20 1req n GLU 436 Cb 0.00 -1.51 -0.02 0.00 -0.57 0.00 0.00 31.44 29.33 1req n GLU 436 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1req h HIS 437 N 3.38 -0.32 -0.18 -0.32 2.76 -1.87 -0.97 115.15 117.63 1req h HIS 437 Ca 0.00 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.19 1req h HIS 437 Cb 0.97 0.10 -0.05 0.00 1.55 0.00 0.00 27.41 29.99 1req h HIS 437 CO 0.43 -0.20 -0.39 0.28 -1.30 0.00 0.00 177.93 176.76 1req h VAL 438 N -0.35 0.00 -0.80 5.26 2.07 -1.84 -2.40 116.25 118.19 1req h VAL 438 Ca -0.03 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.64 1req h VAL 438 Cb 0.26 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.88 1req h VAL 438 CO 0.06 0.00 -0.22 0.74 0.02 0.00 0.00 177.57 178.17 1req h THR 439 N -0.35 0.18 -0.58 2.57 2.02 -1.86 -1.86 112.91 113.02 1req h THR 439 Ca 0.03 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.28 1req h THR 439 Cb 0.45 0.18 -0.06 0.00 -1.74 0.00 0.00 68.15 66.99 1req h THR 439 CO -0.35 0.00 0.28 0.50 0.37 0.00 0.00 175.52 176.32 1req h LYS 440 N -0.01 0.51 -0.17 6.66 3.64 -0.68 -0.29 116.57 126.23 1req h LYS 440 Ca 0.38 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.70 1req h LYS 440 Cb 0.59 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1req h LYS 440 CO -0.83 0.34 0.00 0.28 -2.27 0.00 0.00 179.45 176.97 1req h VAL 441 N 0.53 1.25 0.22 2.00 2.07 -1.04 -2.33 116.25 118.95 1req h VAL 441 Ca 0.27 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.95 1req h VAL 441 Cb 0.22 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1req h VAL 441 CO -0.21 0.25 -0.18 -0.07 0.02 0.00 0.00 177.57 177.38 1req h LEU 442 N 0.06 -0.48 -0.52 2.57 3.38 -1.30 -0.60 115.31 118.42 1req h LEU 442 Ca 0.05 0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.16 1req h LEU 442 Cb 0.37 0.16 -0.11 0.00 0.09 0.00 0.00 40.66 41.18 1req h LEU 442 CO 0.01 -0.28 -0.27 0.44 0.09 0.00 0.00 178.44 178.42 1req h ASP 443 N -0.42 -0.93 -0.18 -0.43 3.32 -0.99 0.18 116.42 116.97 1req h ASP 443 Ca -0.01 0.20 0.04 0.00 0.02 0.00 0.00 57.03 57.27 1req h ASP 443 Cb 0.38 0.48 -0.03 0.00 0.22 0.00 0.00 39.33 40.38 1req h ASP 443 CO -0.02 -0.28 -0.05 0.00 -1.72 0.00 0.00 179.24 177.17 1req h ALA 444 N 1.10 0.11 0.38 3.45 0.00 -1.10 -0.82 119.26 122.38 1req h ALA 444 Ca 0.23 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1req h ALA 444 Cb 0.51 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1req h ALA 444 CO -0.60 -0.48 -0.24 0.00 0.00 0.00 0.00 179.25 177.93 1req h ASN 446 N -0.59 0.18 0.72 0.00 2.35 -0.69 -2.09 115.58 115.46 1req h ASN 446 Ca -0.04 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.47 1req h ASN 446 Cb 0.49 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1req h ASN 446 CO 0.04 0.11 -1.12 0.00 -1.65 0.00 0.00 177.43 174.81 1req h ALA 447 N 1.76 0.23 -0.01 -0.83 0.00 -0.76 -2.48 119.26 117.17 1req h ALA 447 Ca 0.22 -0.87 -0.16 0.00 0.00 0.00 0.00 54.91 54.10 1req h ALA 447 Cb 0.61 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1req h ALA 447 CO -0.04 1.04 -0.62 1.49 0.00 0.00 0.00 179.25 181.12 1req h GLU 448 N 0.06 0.45 -0.29 0.00 4.57 -1.26 -2.79 114.58 115.33 1req h GLU 448 Ca -0.08 -0.46 -0.04 0.00 -1.18 0.00 0.00 59.36 57.59 1req h GLU 448 Cb 1.84 0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 30.54 1req h GLU 448 CO 0.17 1.11 -0.00 -0.09 -1.18 0.00 0.00 179.01 179.03 1req h ARG 449 N -0.03 0.44 -0.60 1.92 2.43 -1.49 -2.38 114.38 114.67 1req h ARG 449 Ca -0.07 -0.08 -0.10 0.00 -0.81 0.00 0.00 59.98 58.92 1req h ARG 449 Cb 1.32 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.78 1req h ARG 449 CO 0.12 0.47 -0.01 0.00 -1.51 0.00 0.00 179.97 179.04 1req h ALA 450 N 1.58 0.80 0.54 2.80 0.00 -1.47 0.14 119.26 123.66 1req h ALA 450 Ca 0.09 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1req h ALA 450 Cb 0.28 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1req h ALA 450 CO 0.01 0.65 -0.28 -0.22 0.00 0.00 0.00 179.25 179.41 1req h LYS 451 N 0.96 -0.72 -0.69 0.00 3.64 -1.19 -2.03 116.57 116.53 1req h LYS 451 Ca 0.17 0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.55 1req h LYS 451 Cb 0.57 0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.52 1req h LYS 451 CO 0.03 -0.48 0.23 0.00 -2.27 0.00 0.00 179.45 176.96 1req h ARG 452 N -0.75 1.05 -0.33 1.90 3.08 -1.21 -1.95 114.38 116.17 1req h ARG 452 Ca -0.07 -0.21 0.03 0.00 0.07 0.00 0.00 59.98 59.81 1req h ARG 452 Cb 0.59 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 1req h ARG 452 CO 0.10 0.89 0.12 -0.07 -1.07 0.00 0.00 179.97 179.94 1req h LEU 453 N 1.01 0.14 -0.56 3.04 3.38 -0.74 -1.31 115.31 120.28 1req h LEU 453 Ca 0.23 0.03 -0.16 0.00 0.09 0.00 0.00 57.88 58.07 1req h LEU 453 Cb 0.26 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1req h LEU 453 CO -0.01 0.12 -0.64 0.00 0.09 0.00 0.00 178.44 178.00 1req h ALA 454 N 1.20 0.75 -0.02 1.53 0.00 -1.09 -3.02 119.26 118.62 1req h ALA 454 Ca 0.14 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1req h ALA 454 Cb 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1req h ALA 454 CO -0.14 0.74 -0.22 0.27 0.00 0.00 0.00 179.25 179.90 1req n ASN 455 N -3.87 1.74 -2.55 0.00 0.23 -0.76 0.62 115.26 110.67 1req n ASN 455 Ca -0.03 -1.38 -0.18 0.00 -0.53 0.00 0.00 54.58 52.46 1req n ASN 455 Cb 0.64 0.18 0.04 0.00 -2.08 0.00 0.00 39.78 38.56 1req n ASN 455 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1req n ARG 456 N 0.04 -4.64 0.00 -3.83 1.74 -0.56 -4.43 116.66 104.98 1req n ARG 456 Ca 0.13 0.68 0.12 0.00 -0.77 0.00 0.00 57.85 58.01 1req n ARG 456 Cb 0.43 -5.11 0.32 0.00 -1.02 0.00 0.00 32.46 27.07 1req n ARG 456 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1req n LYS 457 N -3.52 0.02 -3.75 5.56 5.02 -0.80 -3.56 118.16 117.13 1req n LYS 457 Ca -0.05 -0.01 -0.29 0.00 -2.02 0.00 0.00 58.31 55.94 1req n LYS 457 Cb 0.58 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.96 1req n LYS 457 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1req s GLN 458 N -2.99 1.67 0.70 1.97 0.74 -0.81 -4.99 119.66 115.95 1req s GLN 458 Ca 0.12 -2.50 -0.11 0.00 0.05 0.00 0.00 55.36 52.92 1req s GLN 458 Cb 0.18 -2.65 0.01 0.00 1.10 0.00 0.00 33.01 31.65 1req s GLN 458 CO 0.67 -1.22 1.07 -1.25 -0.55 0.00 0.00 175.29 174.00 1req s PRO 459 N -0.31 2.88 -0.17 1.67 0.04 -1.23 -4.17 135.00 133.70 1req s PRO 459 Ca 0.22 0.72 0.01 0.00 0.04 0.00 0.00 61.00 61.98 1req s PRO 459 Cb -0.14 -2.00 0.03 0.00 0.04 0.00 0.00 34.50 32.42 1req s PRO 459 CO -0.08 -1.08 -0.15 0.42 0.04 0.00 0.00 177.00 176.15 1req s ILE 460 N -3.18 1.79 0.10 0.56 1.01 -1.26 -5.02 121.20 115.20 1req s ILE 460 Ca 0.58 -0.86 -0.31 0.00 0.00 0.00 0.00 60.65 60.06 1req s ILE 460 Cb -0.13 -1.70 -0.10 0.00 0.01 0.00 0.00 42.46 40.55 1req s ILE 460 CO 0.54 0.41 1.89 -0.89 0.00 0.00 0.00 174.94 176.88 1req s THR 461 N 1.38 2.63 -0.01 2.92 2.01 -1.26 -1.52 115.64 121.78 1req s THR 461 Ca 0.03 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.03 1req s THR 461 Cb -0.14 -3.00 0.00 0.00 0.01 0.00 0.00 72.50 69.37 1req s THR 461 CO -0.11 -0.00 0.00 0.00 -0.69 0.00 0.00 174.62 173.82 1req n ALA 462 N 6.22 -0.00 0.04 7.40 0.00 -0.52 -4.79 120.51 128.86 1req n ALA 462 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1req n ALA 462 Cb 0.39 -0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.69 1req n ALA 462 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1req n VAL 463 N -2.97 0.23 1.00 0.00 0.31 -1.02 -4.25 118.33 111.62 1req n VAL 463 Ca -0.00 0.08 0.10 0.00 -0.01 0.00 0.00 64.34 64.51 1req n VAL 463 Cb 0.01 -0.69 -0.10 0.00 -0.91 0.00 0.00 33.84 32.15 1req n VAL 463 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1req n SER 464 N -2.89 1.18 -3.96 4.52 3.41 -0.58 -4.59 113.62 110.72 1req n SER 464 Ca 0.00 -1.09 -0.24 0.00 -0.26 0.00 0.00 58.87 57.28 1req n SER 464 Cb 0.00 0.90 -0.17 0.00 -0.26 0.00 0.00 64.21 64.69 1req n SER 464 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1req s GLU 465 N -2.91 1.43 -1.07 4.33 0.41 -1.11 -4.88 118.70 114.90 1req s GLU 465 Ca 0.10 -0.29 -0.26 0.00 -0.41 0.00 0.00 54.97 54.11 1req s GLU 465 Cb 0.16 -1.31 0.04 0.00 -1.78 0.00 0.00 34.13 31.24 1req s GLU 465 CO 0.82 -0.08 0.63 1.19 -0.49 0.00 0.00 175.26 177.33 1req n PHE 466 N 4.19 -1.47 -1.57 1.61 3.72 -1.26 -1.44 117.46 121.24 1req n PHE 466 Ca -0.20 0.23 -0.30 0.00 -0.05 0.00 0.00 57.45 57.13 1req n PHE 466 Cb 0.51 -2.63 0.10 0.00 -0.94 0.00 0.00 39.48 36.52 1req n PHE 466 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1req s PRO 467 N -6.77 1.86 -0.12 -1.08 0.04 -1.26 -4.45 135.00 123.22 1req s PRO 467 Ca 0.36 0.52 -0.01 0.00 0.04 0.00 0.00 61.00 61.92 1req s PRO 467 Cb -0.20 -1.90 0.03 0.00 0.04 0.00 0.00 34.50 32.47 1req s PRO 467 CO 0.92 -1.75 -0.06 1.41 0.04 0.00 0.00 177.00 177.57 1req s MET 468 N -5.21 1.34 0.08 4.56 1.75 -1.26 -4.93 119.30 115.63 1req s MET 468 Ca 0.61 -0.27 -0.31 0.00 -1.25 0.00 0.00 55.69 54.48 1req s MET 468 Cb -0.14 -1.62 -0.10 0.00 2.84 0.00 0.00 34.83 35.81 1req s MET 468 CO 0.54 -0.33 1.88 0.42 -0.65 0.00 0.00 175.02 176.89 1req s ILE 469 N 1.73 2.78 0.00 10.11 1.01 -1.26 -1.91 121.20 133.66 1req s ILE 469 Ca 0.04 0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.75 1req s ILE 469 Cb -0.13 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.30 1req s ILE 469 CO -0.08 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.47 1req n GLY 470 N 4.37 0.81 3.71 6.18 0.00 -1.26 -5.01 105.19 113.99 1req n GLY 470 Ca 0.19 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 1req n GLY 470 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req n ALA 471 N -0.86 1.40 -1.72 4.61 0.00 -0.80 -4.83 120.51 118.32 1req n ALA 471 Ca 0.00 0.22 -0.43 0.00 0.00 0.00 0.00 53.44 53.23 1req n ALA 471 Cb 0.00 -2.30 -0.02 0.00 0.00 0.00 0.00 19.45 17.14 1req n ALA 471 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1req n ARG 472 N -0.28 2.50 -0.79 0.00 0.63 -1.26 -4.58 116.66 112.88 1req n ARG 472 Ca 0.08 0.89 0.00 0.00 -0.92 0.00 0.00 57.85 57.90 1req n ARG 472 Cb 0.41 -2.64 0.00 0.00 0.45 0.00 0.00 32.46 30.69 1req n ARG 472 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1req n SER 473 N 2.22 1.84 -3.77 6.15 2.88 -1.26 -4.09 113.62 117.59 1req n SER 473 Ca 0.10 -0.40 -0.13 0.00 -1.33 0.00 0.00 58.87 57.11 1req n SER 473 Cb 0.35 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.71 1req n SER 473 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1req s ILE 474 N 0.08 0.02 0.25 2.46 2.07 -1.26 -5.03 121.20 119.79 1req s ILE 474 Ca 0.00 -0.19 -0.30 0.00 -1.41 0.00 0.00 60.65 58.76 1req s ILE 474 Cb 0.00 -0.50 -0.09 0.00 0.13 0.00 0.00 42.46 42.00 1req s ILE 474 CO 0.00 -0.10 1.24 -1.61 -1.91 0.00 0.00 174.94 172.56 1req s GLU 475 N -0.39 4.46 0.17 3.50 0.41 -1.26 -5.04 118.70 120.54 1req s GLU 475 Ca -0.05 2.00 0.03 0.00 -0.41 0.00 0.00 54.97 56.54 1req s GLU 475 Cb -0.03 -3.17 -0.05 0.00 -1.78 0.00 0.00 34.13 29.10 1req s GLU 475 CO 0.02 -0.10 -0.03 0.95 -0.49 0.00 0.00 175.26 175.61 1req s THR 476 N -0.53 0.85 -0.08 3.63 -4.23 -1.26 -4.57 115.64 109.43 1req s THR 476 Ca 0.51 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.74 1req s THR 476 Cb -0.36 -2.05 -0.02 0.00 1.34 0.00 0.00 72.50 71.41 1req s THR 476 CO 0.42 -0.55 0.91 -0.54 -0.54 0.00 0.00 174.62 174.32 1req s LYS 477 N -3.86 4.44 0.27 3.99 1.02 0.84 -4.84 119.74 121.60 1req s LYS 477 Ca 0.22 1.24 -0.28 0.00 0.02 0.00 0.00 55.97 57.16 1req s LYS 477 Cb 0.05 -3.51 -0.14 0.00 -0.52 0.00 0.00 37.83 33.71 1req s LYS 477 CO 0.03 -0.18 0.96 -2.30 -0.92 0.00 0.00 175.35 172.94 1req n PRO 478 N 4.54 1.18 -2.57 -1.68 -0.02 -1.26 0.34 135.00 135.53 1req n PRO 478 Ca 0.05 0.41 -0.41 0.00 -2.02 0.00 0.00 63.50 61.53 1req n PRO 478 Cb 0.50 -1.75 -0.04 0.00 -0.02 0.00 0.00 33.50 32.20 1req n PRO 478 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1req s PHE 479 N -0.99 3.61 0.41 6.00 0.08 -1.26 -4.64 117.98 121.18 1req s PHE 479 Ca 0.60 1.58 -0.23 0.00 0.12 0.00 0.00 56.93 59.00 1req s PHE 479 Cb -0.74 -3.24 -0.12 0.00 -0.57 0.00 0.00 43.02 38.35 1req s PHE 479 CO 0.59 -0.51 0.62 -2.30 -0.10 0.00 0.00 175.22 173.52 1req n PRO 480 N 3.15 0.67 -1.35 0.24 -0.02 -1.26 -4.89 135.00 131.55 1req n PRO 480 Ca 0.05 0.24 -0.35 0.00 -2.02 0.00 0.00 63.50 61.42 1req n PRO 480 Cb 0.48 -1.57 0.09 0.00 -0.02 0.00 0.00 33.50 32.48 1req n PRO 480 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1req n ALA 481 N -0.76 -0.04 -2.62 3.55 0.00 -1.26 -4.91 120.51 114.47 1req n ALA 481 Ca 0.11 -0.20 -0.32 0.00 0.00 0.00 0.00 53.44 53.04 1req n ALA 481 Cb 0.39 -2.17 -0.15 0.00 0.00 0.00 0.00 19.45 17.52 1req n ALA 481 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1req s ALA 482 N -1.83 2.31 0.20 0.00 0.00 -1.26 -4.54 121.76 116.65 1req s ALA 482 Ca 0.74 -1.03 -0.30 0.00 0.00 0.00 0.00 51.96 51.37 1req s ALA 482 Cb -0.34 -0.76 -0.09 0.00 0.00 0.00 0.00 23.12 21.93 1req s ALA 482 CO 0.49 0.46 1.38 -2.14 0.00 0.00 0.00 175.76 175.94 1req s PRO 483 N -0.33 4.33 0.75 0.00 0.02 -1.26 -4.97 135.00 133.54 1req s PRO 483 Ca 0.02 2.15 -0.16 0.00 0.02 0.00 0.00 61.00 63.03 1req s PRO 483 Cb -0.12 -3.17 -0.03 0.00 0.02 0.00 0.00 34.50 31.19 1req s PRO 483 CO 0.02 -0.35 0.50 0.00 -0.33 0.00 0.00 177.00 176.84 1req n ALA 484 N 2.80 -1.69 -2.42 -1.55 0.00 -1.26 -5.04 120.51 111.36 1req n ALA 484 Ca 0.08 -0.29 -0.18 0.00 0.00 0.00 0.00 53.44 53.05 1req n ALA 484 Cb 0.42 -1.84 -0.11 0.00 0.00 0.00 0.00 19.45 17.92 1req n ALA 484 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1req s ARG 485 N -2.85 1.13 -0.00 0.00 0.52 -1.26 -5.05 118.95 111.44 1req s ARG 485 Ca 0.64 -1.37 0.03 0.00 -0.52 0.00 0.00 55.73 54.51 1req s ARG 485 Cb -0.33 -0.96 -0.04 0.00 0.52 0.00 0.00 34.95 34.14 1req s ARG 485 CO 0.59 0.17 0.13 1.63 0.02 0.00 0.00 175.30 177.85 1req n LYS 486 N 0.18 5.55 0.00 3.54 5.02 -1.22 -5.01 118.16 126.20 1req n LYS 486 Ca -0.13 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1req n LYS 486 Cb 0.58 -0.68 0.00 0.00 -0.02 0.00 0.00 35.03 34.91 1req n LYS 486 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1req n GLY 487 N 1.16 1.34 3.68 0.72 0.00 -1.10 -4.62 105.19 106.37 1req n GLY 487 Ca 0.01 -1.54 -0.48 0.00 0.00 0.00 0.00 46.02 44.00 1req n GLY 487 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1req n LEU 488 N 0.00 3.41 -4.75 0.99 4.77 -0.79 -4.93 117.00 115.70 1req n LEU 488 Ca 0.00 0.98 -0.40 0.00 -0.03 0.00 0.00 56.01 56.56 1req n LEU 488 Cb 0.00 -1.37 -0.05 0.00 -2.33 0.00 0.00 43.42 39.67 1req n LEU 488 CO 0.00 -0.08 0.74 0.00 -1.33 0.00 0.00 177.39 176.73 1req s ALA 489 N 3.79 3.37 -0.25 -1.18 0.00 -1.26 -4.93 121.76 121.30 1req s ALA 489 Ca 0.92 0.78 -0.03 0.00 0.00 0.00 0.00 51.96 53.62 1req s ALA 489 Cb -0.69 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.14 1req s ALA 489 CO 0.50 -0.05 -0.03 -1.58 0.00 0.00 0.00 175.76 174.60 1req s TRP 490 N -0.90 3.04 -0.10 0.00 0.52 -1.26 -4.22 118.94 116.01 1req s TRP 490 Ca 0.45 -1.25 -0.03 0.00 0.02 0.00 0.00 56.10 55.29 1req s TRP 490 Cb -0.29 -2.11 0.04 0.00 -1.15 0.00 0.00 33.47 29.96 1req s TRP 490 CO 0.36 -0.64 0.06 -1.01 0.02 0.00 0.00 176.95 175.74 1req s HIS 491 N 1.41 0.27 0.74 -1.98 3.76 -1.24 -5.04 115.29 113.21 1req s HIS 491 Ca 0.03 -0.07 -0.15 0.00 -0.15 0.00 0.00 55.06 54.71 1req s HIS 491 Cb -0.16 -0.64 0.04 0.00 1.11 0.00 0.00 32.58 32.94 1req s HIS 491 CO -0.03 -0.35 1.21 1.03 -0.85 0.00 0.00 174.74 175.76 1req s ARG 492 N 2.11 2.07 0.38 1.40 0.52 -1.26 -4.91 118.95 119.26 1req s ARG 492 Ca 0.04 1.78 0.08 0.00 -0.52 0.00 0.00 55.73 57.11 1req s ARG 492 Cb -0.14 -1.82 0.82 0.00 0.52 0.00 0.00 34.95 34.33 1req s ARG 492 CO -0.06 -1.90 1.96 -0.44 0.02 0.00 0.00 175.30 174.88 1req h ASP 493 N -0.36 0.58 -0.06 0.23 3.32 -1.63 -2.83 116.42 115.68 1req h ASP 493 Ca -0.48 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1req h ASP 493 Cb 1.30 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1req h ASP 493 CO 0.49 0.37 0.00 -1.54 -1.72 0.00 0.00 179.24 176.84 1req n SER 494 N -4.48 0.66 0.23 6.45 3.41 -1.26 -4.28 113.62 114.33 1req n SER 494 Ca 0.11 -1.53 0.08 0.00 -0.26 0.00 0.00 58.87 57.27 1req n SER 494 Cb 0.28 -0.04 0.54 0.00 -0.26 0.00 0.00 64.21 64.73 1req n SER 494 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1req h GLU 495 N 0.88 0.00 -0.57 4.33 5.08 -1.87 -1.95 114.58 120.48 1req h GLU 495 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1req h GLU 495 Cb 0.19 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 1req h GLU 495 CO 0.00 0.23 0.32 -0.24 -1.00 0.00 0.00 179.01 178.32 1req h VAL 496 N 0.00 1.18 -0.09 3.13 3.04 -1.84 -1.56 116.25 120.12 1req h VAL 496 Ca -0.00 -0.46 -0.17 0.00 -1.01 0.00 0.00 66.70 65.06 1req h VAL 496 Cb 0.53 0.45 -0.01 0.00 -2.01 0.00 0.00 31.29 30.25 1req h VAL 496 CO 0.03 0.20 -0.66 -0.26 -1.01 0.00 0.00 177.57 175.86 1req h PHE 497 N 0.77 0.47 0.00 3.17 0.04 -1.76 -2.92 116.94 116.70 1req h PHE 497 Ca 0.20 -0.19 -0.06 0.00 2.80 0.00 0.00 57.97 60.72 1req h PHE 497 Cb 0.03 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 1req h PHE 497 CO -0.01 0.91 -0.29 0.93 -0.60 0.00 0.00 178.31 179.25 1req h GLU 498 N 0.25 0.00 -0.05 1.51 5.08 -0.91 -1.39 114.58 119.08 1req h GLU 498 Ca -0.02 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1req h GLU 498 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1req h GLU 498 CO 0.11 0.29 -0.64 1.96 -1.00 0.00 0.00 179.01 179.73 1req h GLN 499 N 0.00 0.20 -0.29 2.33 4.20 -1.23 0.13 115.11 120.46 1req h GLN 499 Ca -0.00 -0.15 -0.06 0.00 0.06 0.00 0.00 58.65 58.50 1req h GLN 499 Cb 0.56 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 1req h GLN 499 CO 0.04 0.77 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.85 1req h LEU 500 N 0.14 0.53 -0.98 1.46 3.38 -1.24 -2.17 115.31 116.44 1req h LEU 500 Ca -0.01 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.56 1req h LEU 500 Cb 1.15 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 1req h LEU 500 CO 0.10 0.76 0.19 0.24 0.09 0.00 0.00 178.44 179.81 1req h MET 501 N 0.30 0.93 -0.85 1.13 2.86 -1.17 -2.24 114.93 115.88 1req h MET 501 Ca 0.07 -0.18 0.07 0.00 -2.06 0.00 0.00 59.70 57.61 1req h MET 501 Cb 0.51 -0.14 -0.07 0.00 0.06 0.00 0.00 31.60 31.96 1req h MET 501 CO 0.02 0.80 0.51 -0.44 1.06 0.00 0.00 176.91 178.87 1req h ASP 502 N 0.90 0.78 -0.20 1.22 3.32 -0.59 -0.50 116.42 121.34 1req h ASP 502 Ca 0.20 0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.31 1req h ASP 502 Cb 0.26 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 1req h ASP 502 CO -0.01 0.48 0.03 0.03 -1.72 0.00 0.00 179.24 178.05 1req h ARG 503 N 0.91 0.10 -0.19 3.56 3.08 -0.77 -2.36 114.38 118.71 1req h ARG 503 Ca 0.38 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 60.33 1req h ARG 503 Cb 0.24 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1req h ARG 503 CO -0.20 0.07 -0.30 0.77 -1.07 0.00 0.00 179.97 179.24 1req h SER 504 N 0.10 0.38 0.16 7.04 0.02 -1.40 -2.86 113.55 117.00 1req h SER 504 Ca 0.09 -0.14 -0.07 0.00 -0.84 0.00 0.00 61.79 60.83 1req h SER 504 Cb 0.10 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 1req h SER 504 CO -0.13 0.67 -0.26 0.74 -1.14 0.00 0.00 176.83 176.71 1req h THR 505 N 0.33 1.23 0.00 -2.27 2.02 -0.95 -3.26 112.91 110.02 1req h THR 505 Ca 0.04 -1.09 -0.05 0.00 0.77 0.00 0.00 66.41 66.08 1req h THR 505 Cb 0.70 1.45 -0.01 0.00 -1.74 0.00 0.00 68.15 68.56 1req h THR 505 CO 0.05 0.33 -0.25 0.77 0.37 0.00 0.00 175.52 176.79 1req h SER 506 N 0.16 0.00 -2.91 4.18 4.64 -1.18 -3.45 113.55 114.99 1req h SER 506 Ca 0.03 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.86 1req h SER 506 Cb 0.56 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.66 1req h SER 506 CO 0.04 0.25 -0.17 -0.69 -0.87 0.00 0.00 176.83 175.38 1req s VAL 507 N -3.98 5.09 0.20 0.95 1.01 -1.23 -5.04 120.40 117.40 1req s VAL 507 Ca -0.02 -0.34 -0.10 0.00 0.00 0.00 0.00 61.98 61.52 1req s VAL 507 Cb 0.12 -3.84 0.13 0.00 0.00 0.00 0.00 36.38 32.80 1req s VAL 507 CO 0.65 -0.53 1.80 -1.28 0.00 0.00 0.00 175.10 175.74 1req h SER 508 N 0.91 0.92 -3.41 3.32 0.87 -1.89 -3.42 113.55 110.85 1req h SER 508 Ca -0.49 -0.12 -0.51 0.00 -1.23 0.00 0.00 61.79 59.44 1req h SER 508 Cb 1.21 -0.24 -0.34 0.00 -0.44 0.00 0.00 62.40 62.60 1req h SER 508 CO 0.62 0.78 -0.81 -0.70 -0.53 0.00 0.00 176.83 176.19 1req s GLU 509 N -5.76 1.61 0.21 2.24 -6.30 -1.26 -5.11 118.70 104.34 1req s GLU 509 Ca -0.13 -0.38 -0.32 0.00 -2.50 0.00 0.00 54.97 51.64 1req s GLU 509 Cb 0.14 -1.36 -0.13 0.00 0.00 0.00 0.00 34.13 32.78 1req s GLU 509 CO 0.80 0.00 1.61 -2.13 0.02 0.00 0.00 175.26 175.56 1req n ARG 510 N 3.89 2.45 -1.55 4.30 0.63 -1.26 -4.93 116.66 120.19 1req n ARG 510 Ca -0.23 0.88 -0.37 0.00 -0.92 0.00 0.00 57.85 57.21 1req n ARG 510 Cb 0.52 -2.66 0.06 0.00 0.45 0.00 0.00 32.46 30.82 1req n ARG 510 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1req n PRO 511 N 3.16 0.74 -4.02 -0.14 -0.02 -1.26 -4.78 135.00 128.67 1req n PRO 511 Ca 0.14 0.30 -0.12 0.00 -2.02 0.00 0.00 63.50 61.80 1req n PRO 511 Cb 0.33 -2.10 -0.12 0.00 -0.02 0.00 0.00 33.50 31.58 1req n PRO 511 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1req s LYS 512 N -2.78 0.37 -0.11 -0.52 1.02 -1.26 -1.28 119.74 115.17 1req s LYS 512 Ca 0.75 -0.52 0.01 0.00 0.02 0.00 0.00 55.97 56.23 1req s LYS 512 Cb -0.40 -0.14 0.02 0.00 -0.52 0.00 0.00 37.83 36.79 1req s LYS 512 CO 0.48 0.02 -0.14 0.08 -0.92 0.00 0.00 175.35 174.88 1req s VAL 513 N -1.03 1.41 -0.16 3.17 1.01 -0.37 -4.49 120.40 119.95 1req s VAL 513 Ca -0.09 -0.57 -0.20 0.00 0.00 0.00 0.00 61.98 61.11 1req s VAL 513 Cb -0.07 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 1req s VAL 513 CO -0.00 0.43 0.60 0.12 0.00 0.00 0.00 175.10 176.25 1req s PHE 514 N 1.17 3.44 -0.37 5.22 5.36 -0.18 -3.52 117.98 129.10 1req s PHE 514 Ca -0.03 0.96 -0.20 0.00 -0.96 0.00 0.00 56.93 56.70 1req s PHE 514 Cb -0.14 -2.74 0.01 0.00 -0.34 0.00 0.00 43.02 39.80 1req s PHE 514 CO -0.04 -0.05 0.62 -0.51 -1.46 0.00 0.00 175.22 173.78 1req s LEU 515 N 1.44 4.30 -0.97 6.12 1.43 -0.00 -1.06 118.68 129.94 1req s LEU 515 Ca 0.29 0.05 -0.18 0.00 -1.03 0.00 0.00 54.13 53.26 1req s LEU 515 Cb -0.16 -2.75 0.13 0.00 0.03 0.00 0.00 46.19 43.44 1req s LEU 515 CO 0.12 -0.61 1.18 0.00 0.23 0.00 0.00 176.35 177.27 1req s ALA 516 N 2.69 3.39 -0.15 4.21 0.00 -0.59 -2.00 121.76 129.32 1req s ALA 516 Ca 0.23 -2.80 -0.25 0.00 0.00 0.00 0.00 51.96 49.14 1req s ALA 516 Cb -0.14 -4.09 -0.02 0.00 0.00 0.00 0.00 23.12 18.86 1req s ALA 516 CO 0.15 -3.00 0.80 0.00 0.00 0.00 0.00 175.76 173.71 1req s LEU 518 N 1.84 4.24 0.00 0.00 1.43 -0.18 -1.22 118.68 124.80 1req s LEU 518 Ca 0.38 0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.88 1req s LEU 518 Cb -0.17 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 43.98 1req s LEU 518 CO 0.14 0.39 0.00 0.61 0.23 0.00 0.00 176.35 177.72 1req n GLY 519 N 1.91 -0.24 3.99 -3.19 0.00 -1.26 -4.07 105.19 102.33 1req n GLY 519 Ca -0.19 -1.38 -0.18 0.00 0.00 0.00 0.00 46.02 44.27 1req n GLY 519 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1req s THR 520 N 0.00 2.80 0.39 2.61 -4.23 -1.26 -3.81 115.64 112.14 1req s THR 520 Ca 0.00 -1.06 0.11 0.00 -1.18 0.00 0.00 61.69 59.56 1req s THR 520 Cb 0.00 -2.86 0.32 0.00 1.34 0.00 0.00 72.50 71.30 1req s THR 520 CO 0.00 0.00 1.93 -0.09 -0.54 0.00 0.00 174.62 175.92 1req h ARG 521 N 0.64 0.56 -0.96 3.99 2.43 -1.93 0.23 114.38 119.33 1req h ARG 521 Ca -0.39 -0.03 0.17 0.00 -0.81 0.00 0.00 59.98 58.92 1req h ARG 521 Cb 1.28 -0.13 -0.09 0.00 -0.42 0.00 0.00 29.97 30.62 1req h ARG 521 CO 0.47 0.37 0.61 0.00 -1.51 0.00 0.00 179.97 179.90 1req h ARG 522 N 0.58 0.70 0.12 0.20 3.08 -1.98 -0.37 114.38 116.70 1req h ARG 522 Ca 0.36 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.36 1req h ARG 522 Cb 0.60 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1req h ARG 522 CO -0.13 0.46 -0.06 -0.44 -1.07 0.00 0.00 179.97 178.73 1req h ASP 523 N 0.72 -0.14 0.87 7.04 3.32 -1.28 -3.42 116.42 123.52 1req h ASP 523 Ca 0.51 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1req h ASP 523 Cb 0.84 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.43 1req h ASP 523 CO -0.27 0.45 -0.84 2.19 -1.72 0.00 0.00 179.24 179.04 1req h PHE 524 N -0.98 0.00 -0.68 4.55 -5.15 -1.36 -2.86 116.94 110.45 1req h PHE 524 Ca -0.02 0.00 0.13 0.00 -0.20 0.00 0.00 57.97 57.89 1req h PHE 524 Cb 0.41 0.00 -0.09 0.00 0.22 0.00 0.00 35.95 36.49 1req h PHE 524 CO 0.08 0.00 0.20 0.78 -2.00 0.00 0.00 178.31 177.37 1req h GLY 525 N 4.29 0.96 0.69 6.09 0.00 -1.30 0.27 103.07 114.06 1req h GLY 525 Ca 0.00 -0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.29 1req h GLY 525 CO 0.00 -0.12 0.07 -1.33 0.00 0.00 0.00 176.54 175.16 1req h GLY 526 N 0.33 0.34 1.73 4.60 0.00 -1.83 -0.59 103.07 107.65 1req h GLY 526 Ca 0.37 -0.03 -0.22 0.00 0.00 0.00 0.00 47.33 47.45 1req h GLY 526 CO -0.42 -0.00 -0.96 3.21 0.00 0.00 0.00 176.54 178.37 1req h ARG 527 N 0.18 0.23 -0.44 4.80 -0.00 -1.80 -2.61 114.38 114.75 1req h ARG 527 Ca 0.13 -0.28 -0.10 0.00 -0.50 0.00 0.00 59.98 59.23 1req h ARG 527 Cb 0.13 0.09 -0.01 0.00 0.00 0.00 0.00 29.97 30.17 1req h ARG 527 CO -0.16 1.03 -0.13 1.49 0.00 0.00 0.00 179.97 182.19 1req h GLU 528 N 0.12 0.87 -0.81 0.04 4.22 -0.92 -1.28 114.58 116.81 1req h GLU 528 Ca -0.06 -0.34 0.09 0.00 0.08 0.00 0.00 59.36 59.13 1req h GLU 528 Cb 1.62 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.75 1req h GLU 528 CO 0.15 0.98 0.46 0.78 -2.18 0.00 0.00 179.01 179.21 1req h GLY 529 N 0.70 1.26 0.70 1.92 0.00 -1.04 -2.04 103.07 104.57 1req h GLY 529 Ca 0.11 -0.31 -0.09 0.00 0.00 0.00 0.00 47.33 47.03 1req h GLY 529 CO 0.05 0.13 -0.32 -2.75 0.00 0.00 0.00 176.54 173.65 1req h PHE 530 N 0.78 0.47 0.06 5.60 3.57 -1.29 -3.40 116.94 122.72 1req h PHE 530 Ca 0.39 -0.20 -0.26 0.00 3.53 0.00 0.00 57.97 61.43 1req h PHE 530 Cb 0.35 -0.07 0.01 0.00 2.79 0.00 0.00 35.95 39.03 1req h PHE 530 CO -0.06 0.94 -1.10 0.77 -2.23 0.00 0.00 178.31 176.62 1req h SER 531 N -0.14 0.65 0.25 0.41 0.02 -1.12 -3.28 113.55 110.34 1req h SER 531 Ca -0.02 -0.57 0.01 0.00 -0.84 0.00 0.00 61.79 60.37 1req h SER 531 Cb 0.97 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.27 1req h SER 531 CO 0.07 1.39 -0.41 -1.28 -1.14 0.00 0.00 176.83 175.46 1req h SER 532 N 0.23 -1.16 -0.71 3.07 0.87 -1.60 -1.45 113.55 112.81 1req h SER 532 Ca -0.13 0.12 0.04 0.00 -1.23 0.00 0.00 61.79 60.59 1req h SER 532 Cb 1.76 0.41 -0.04 0.00 -0.44 0.00 0.00 62.40 64.10 1req h SER 532 CO 0.20 -0.51 0.47 -0.65 -0.53 0.00 0.00 176.83 175.80 1req h PRO 533 N -0.73 0.82 0.08 2.24 0.11 -1.78 -2.40 132.00 130.35 1req h PRO 533 Ca -0.00 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1req h PRO 533 Cb 0.70 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 1req h PRO 533 CO -0.16 0.54 -0.08 0.28 -0.21 0.00 0.00 178.00 178.38 1req h VAL 534 N 0.85 0.82 -0.77 3.15 2.07 -1.33 -2.42 116.25 118.62 1req h VAL 534 Ca 0.29 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.81 1req h VAL 534 Cb 0.08 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 1req h VAL 534 CO -0.08 0.00 0.48 -0.50 0.02 0.00 0.00 177.57 177.49 1req h TRP 535 N -0.17 0.99 0.00 1.57 4.06 -1.35 -1.60 115.95 119.45 1req h TRP 535 Ca 0.00 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.95 1req h TRP 535 Cb 0.17 -0.33 -0.00 0.00 -1.00 0.00 0.00 29.16 28.00 1req h TRP 535 CO -0.11 0.65 -0.07 0.45 -3.56 0.00 0.00 178.44 175.80 1req h HIS 536 N 1.05 0.00 -0.59 0.49 3.86 -0.97 -2.82 115.15 116.18 1req h HIS 536 Ca 0.28 0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.58 1req h HIS 536 Cb -0.08 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.32 1req h HIS 536 CO 0.00 0.07 0.21 0.82 0.86 0.00 0.00 177.93 179.89 1req h ILE 537 N 0.00 0.77 -0.01 2.45 2.04 -0.87 -1.78 117.51 120.11 1req h ILE 537 Ca -0.00 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1req h ILE 537 Cb 0.18 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 1req h ILE 537 CO 0.01 0.07 0.00 0.00 0.00 0.00 0.00 178.15 178.23 1req n ALA 538 N -2.47 2.56 -3.20 1.87 0.00 -1.12 -4.46 120.51 113.69 1req n ALA 538 Ca 0.08 -0.08 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1req n ALA 538 Cb 0.26 -1.16 0.05 0.00 0.00 0.00 0.00 19.45 18.61 1req n ALA 538 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1req n GLY 539 N 0.67 -0.35 3.68 0.00 0.00 -0.67 -4.19 105.19 104.34 1req n GLY 539 Ca 0.08 0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1req n GLY 539 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1req s ILE 540 N -3.19 5.22 0.69 -0.61 1.01 -1.08 -4.64 121.20 118.60 1req s ILE 540 Ca 0.40 0.68 -0.14 0.00 0.00 0.00 0.00 60.65 61.59 1req s ILE 540 Cb -0.17 -3.71 0.02 0.00 0.01 0.00 0.00 42.46 38.60 1req s ILE 540 CO 0.49 0.28 1.12 -1.81 0.00 0.00 0.00 174.94 175.02 1req s ASP 541 N 0.93 4.82 -0.51 3.58 1.01 -0.40 -3.73 116.67 122.36 1req s ASP 541 Ca 0.19 2.04 0.06 0.00 0.71 0.00 0.00 52.55 55.56 1req s ASP 541 Cb -0.14 -2.55 0.23 0.00 1.01 0.00 0.00 42.92 41.46 1req s ASP 541 CO 0.07 -1.83 0.56 0.35 0.21 0.00 0.00 175.17 174.54 1req n THR 542 N -2.64 0.48 -1.80 -1.27 -2.24 -1.26 -1.24 114.28 104.31 1req n THR 542 Ca 0.11 -4.40 -0.36 0.00 -2.27 0.00 0.00 64.05 57.12 1req n THR 542 Cb 0.52 -1.98 0.06 0.00 -2.10 0.00 0.00 70.33 66.82 1req n THR 542 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1req s PRO 543 N -1.42 2.66 0.29 -0.78 0.04 -1.23 -4.70 135.00 129.85 1req s PRO 543 Ca 0.35 1.91 -0.11 0.00 0.04 0.00 0.00 61.00 63.19 1req s PRO 543 Cb 0.11 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.78 1req s PRO 543 CO -0.10 -1.47 0.52 1.14 0.04 0.00 0.00 177.00 177.13 1req s GLN 544 N -3.46 1.72 -0.02 4.56 -2.07 -1.26 -0.82 119.66 118.31 1req s GLN 544 Ca 0.79 -1.38 0.02 0.00 -1.82 0.00 0.00 55.36 52.97 1req s GLN 544 Cb -0.33 0.49 0.00 0.00 -1.09 0.00 0.00 33.01 32.08 1req s GLN 544 CO 0.38 -0.73 -0.08 0.54 -1.32 0.00 0.00 175.29 174.08 1req s VAL 545 N -3.59 0.70 -1.03 3.63 0.11 -0.84 -4.94 120.40 114.44 1req s VAL 545 Ca 0.23 -0.32 -0.12 0.00 -2.93 0.00 0.00 61.98 58.85 1req s VAL 545 Cb -0.01 -0.62 0.24 0.00 -1.53 0.00 0.00 36.38 34.45 1req s VAL 545 CO 0.12 0.22 1.05 -1.61 -3.33 0.00 0.00 175.10 171.55 1req s GLU 546 N 0.19 3.97 2.75 1.54 2.02 -1.26 -2.54 118.70 125.37 1req s GLU 546 Ca -0.03 -2.81 0.00 0.00 0.02 0.00 0.00 54.97 52.16 1req s GLU 546 Cb -0.08 -4.61 0.00 0.00 0.10 0.00 0.00 34.13 29.54 1req s GLU 546 CO 0.00 -1.36 0.00 0.41 0.02 0.00 0.00 175.26 174.33 1req n GLY 547 N 3.47 0.32 0.00 -1.39 0.00 -0.36 -4.96 105.19 102.28 1req n GLY 547 Ca 0.23 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1req n GLY 547 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1req n GLY 548 N 0.00 0.10 3.99 -0.02 0.00 -1.26 -4.70 105.19 103.30 1req n GLY 548 Ca 0.00 -2.29 -0.24 0.00 0.00 0.00 0.00 46.02 43.48 1req n GLY 548 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1req s THR 549 N -0.23 2.05 0.14 2.61 -4.23 -1.26 -4.73 115.64 109.99 1req s THR 549 Ca 0.00 -0.53 -0.15 0.00 -1.18 0.00 0.00 61.69 59.83 1req s THR 549 Cb 0.00 -2.51 0.01 0.00 1.34 0.00 0.00 72.50 71.34 1req s THR 549 CO 0.00 0.00 1.68 0.74 -0.54 0.00 0.00 174.62 176.50 1req h THR 550 N -0.73 1.21 -0.12 3.99 2.02 -1.97 -1.21 112.91 116.11 1req h THR 550 Ca -0.36 -0.68 -0.00 0.00 0.77 0.00 0.00 66.41 66.13 1req h THR 550 Cb 1.26 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 1req h THR 550 CO 0.37 0.25 0.06 0.00 0.37 0.00 0.00 175.52 176.58 1req h ALA 551 N 1.01 0.15 -0.73 6.16 0.00 -1.99 -1.09 119.26 122.77 1req h ALA 551 Ca 0.15 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1req h ALA 551 Cb 0.23 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 1req h ALA 551 CO -0.01 -0.31 0.40 0.93 0.00 0.00 0.00 179.25 180.26 1req h GLU 552 N 0.09 0.68 0.09 0.00 5.08 -1.89 0.17 114.58 118.80 1req h GLU 552 Ca 0.04 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1req h GLU 552 Cb 0.08 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1req h GLU 552 CO -0.01 0.45 -0.11 0.82 -1.00 0.00 0.00 179.01 179.16 1req h ILE 553 N 0.70 0.75 -0.90 3.13 2.04 -0.92 0.06 117.51 122.35 1req h ILE 553 Ca 0.34 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.19 1req h ILE 553 Cb 0.29 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 1req h ILE 553 CO -0.23 0.00 0.53 0.58 0.00 0.00 0.00 178.15 179.03 1req h VAL 554 N -0.23 1.25 -0.46 1.67 2.07 -0.72 0.15 116.25 119.98 1req h VAL 554 Ca 0.01 -0.58 -0.11 0.00 0.82 0.00 0.00 66.70 66.84 1req h VAL 554 Cb 0.23 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 1req h VAL 554 CO -0.04 0.27 -0.16 -0.08 0.02 0.00 0.00 177.57 177.58 1req h GLU 555 N 1.25 0.88 -0.27 1.57 4.57 -0.46 -0.82 114.58 121.29 1req h GLU 555 Ca 0.32 -0.33 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 1req h GLU 555 Cb -0.03 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 1req h GLU 555 CO -0.06 0.97 0.11 0.00 -1.18 0.00 0.00 179.01 178.85 1req h ALA 556 N 1.04 0.35 -0.04 2.92 0.00 -0.49 -1.53 119.26 121.51 1req h ALA 556 Ca 0.12 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1req h ALA 556 Cb 0.69 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 1req h ALA 556 CO 0.05 -0.05 -0.33 0.35 0.00 0.00 0.00 179.25 179.27 1req h PHE 557 N 0.29 -0.91 -0.54 0.00 3.57 -0.41 -1.77 116.94 117.17 1req h PHE 557 Ca 0.09 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.73 1req h PHE 557 Cb 0.18 0.41 -0.11 0.00 2.79 0.00 0.00 35.95 39.22 1req h PHE 557 CO -0.01 -0.42 -0.18 0.87 -2.23 0.00 0.00 178.31 176.35 1req h LYS 558 N -0.46 -0.05 -0.98 1.11 1.57 -0.97 -2.56 116.57 114.23 1req h LYS 558 Ca 0.07 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.91 1req h LYS 558 Cb 0.56 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.82 1req h LYS 558 CO -0.30 -0.03 0.64 -0.22 -0.57 0.00 0.00 179.45 178.97 1req h LYS 559 N -0.05 1.14 -0.39 3.15 1.63 -1.15 -2.89 116.57 118.00 1req h LYS 559 Ca 0.25 -0.07 0.05 0.00 -0.85 0.00 0.00 60.65 60.04 1req h LYS 559 Cb 0.44 -0.26 -0.05 0.00 -0.60 0.00 0.00 32.23 31.77 1req h LYS 559 CO -0.58 0.75 0.12 0.66 -3.45 0.00 0.00 179.45 176.96 1req h SER 560 N 1.17 0.11 0.00 4.20 4.64 -0.91 -3.47 113.55 119.30 1req h SER 560 Ca 0.42 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 1req h SER 560 Cb 0.13 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1req h SER 560 CO -0.16 0.10 0.00 0.61 -0.87 0.00 0.00 176.83 176.51 1req n GLY 561 N -1.23 0.69 3.87 -0.77 0.00 -1.09 -5.04 105.19 101.61 1req n GLY 561 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 1req n GLY 561 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req s ALA 562 N -2.13 3.04 -0.28 4.61 0.00 -1.26 -4.98 121.76 120.76 1req s ALA 562 Ca 0.00 -0.11 0.17 0.00 0.00 0.00 0.00 51.96 52.02 1req s ALA 562 Cb 0.00 -3.08 -0.24 0.00 0.00 0.00 0.00 23.12 19.80 1req s ALA 562 CO 0.00 -0.79 0.48 1.04 0.00 0.00 0.00 175.76 176.49 1req n GLN 563 N -2.82 0.86 -5.14 0.00 6.02 -1.26 -4.94 117.38 110.10 1req n GLN 563 Ca 0.06 -0.10 -0.30 0.00 -0.01 0.00 0.00 57.00 56.65 1req n GLN 563 Cb 0.54 -1.36 -0.15 0.00 1.02 0.00 0.00 30.24 30.29 1req n GLN 563 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1req s VAL 564 N -2.97 2.04 0.17 5.09 1.01 -1.26 -0.45 120.40 124.03 1req s VAL 564 Ca -0.02 -1.20 0.07 0.00 0.00 0.00 0.00 61.98 60.83 1req s VAL 564 Cb 0.11 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 1req s VAL 564 CO 0.70 0.49 -0.14 0.00 0.00 0.00 0.00 175.10 176.15 1req s ALA 565 N -0.67 1.79 -0.13 5.51 0.00 -0.85 -1.01 121.76 126.40 1req s ALA 565 Ca 0.10 -1.54 -0.01 0.00 0.00 0.00 0.00 51.96 50.52 1req s ALA 565 Cb -0.10 -0.06 0.03 0.00 0.00 0.00 0.00 23.12 22.99 1req s ALA 565 CO 0.00 0.05 -0.06 0.34 0.00 0.00 0.00 175.76 176.09 1req s ASP 566 N -3.06 2.32 -0.06 0.00 2.15 -0.22 -0.24 116.67 117.55 1req s ASP 566 Ca 0.18 -0.40 -0.30 0.00 0.43 0.00 0.00 52.55 52.47 1req s ASP 566 Cb -0.01 -0.81 -0.03 0.00 -0.30 0.00 0.00 42.92 41.77 1req s ASP 566 CO 0.05 -0.15 1.20 -0.76 -0.17 0.00 0.00 175.17 175.33 1req s LEU 567 N 1.72 4.27 -0.20 -1.34 1.43 0.51 -1.54 118.68 123.53 1req s LEU 567 Ca 0.04 1.80 -0.02 0.00 -1.03 0.00 0.00 54.13 54.91 1req s LEU 567 Cb -0.13 -3.56 0.06 0.00 0.03 0.00 0.00 46.19 42.59 1req s LEU 567 CO -0.08 -0.59 0.02 0.00 0.23 0.00 0.00 176.35 175.93 1req n SER 569 N 4.98 -0.64 -4.92 0.00 2.88 -1.26 -1.01 113.62 113.66 1req n SER 569 Ca -0.09 -1.33 -0.27 0.00 -1.33 0.00 0.00 58.87 55.85 1req n SER 569 Cb 0.47 1.03 0.06 0.00 -0.75 0.00 0.00 64.21 65.02 1req n SER 569 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1req s SER 570 N -1.90 5.06 0.15 -3.46 1.04 -1.08 -4.76 113.70 108.75 1req s SER 570 Ca 0.08 0.63 -0.21 0.00 0.48 0.00 0.00 55.95 56.94 1req s SER 570 Cb -0.01 -1.37 0.04 0.00 0.10 0.00 0.00 66.02 64.78 1req s SER 570 CO 0.02 -1.46 1.65 0.00 0.98 0.00 0.00 173.24 174.44 1req h ALA 571 N -0.53 0.02 -0.51 5.32 0.00 -1.91 -1.66 119.26 119.99 1req h ALA 571 Ca -0.45 0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.66 1req h ALA 571 Cb 1.29 0.39 -0.10 0.00 0.00 0.00 0.00 17.79 19.37 1req h ALA 571 CO 0.61 -0.58 -0.17 -0.22 0.00 0.00 0.00 179.25 178.90 1req h LYS 572 N -0.15 -0.05 -0.25 0.00 3.64 -1.95 -2.04 116.57 115.78 1req h LYS 572 Ca 0.14 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.40 1req h LYS 572 Cb 0.37 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1req h LYS 572 CO -0.36 -0.03 -0.38 0.28 -2.27 0.00 0.00 179.45 176.69 1req h VAL 573 N -0.05 1.30 -0.56 2.00 2.07 -1.78 -2.92 116.25 116.31 1req h VAL 573 Ca 0.24 -1.53 -0.01 0.00 0.82 0.00 0.00 66.70 66.22 1req h VAL 573 Cb 0.42 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 1req h VAL 573 CO -0.55 0.49 0.32 1.88 0.02 0.00 0.00 177.57 179.73 1req h TYR 574 N 0.47 0.75 -0.69 1.57 0.05 -0.65 -0.71 116.97 117.77 1req h TYR 574 Ca 0.04 -0.01 0.15 0.00 0.05 0.00 0.00 58.73 58.96 1req h TYR 574 Cb 0.88 -0.24 -0.11 0.00 1.01 0.00 0.00 36.73 38.27 1req h TYR 574 CO 0.03 0.53 0.11 0.00 -1.05 0.00 0.00 178.16 177.78 1req h ALA 575 N 1.15 0.81 0.30 3.88 0.00 -1.20 -0.32 119.26 123.88 1req h ALA 575 Ca 0.20 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1req h ALA 575 Cb 0.01 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1req h ALA 575 CO -0.04 -0.36 -0.14 1.96 0.00 0.00 0.00 179.25 180.67 1req h GLN 576 N 0.21 -0.38 -0.01 0.00 4.20 -1.18 -3.43 115.11 114.52 1req h GLN 576 Ca 0.38 0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.11 1req h GLN 576 Cb 0.63 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.50 1req h GLN 576 CO -0.52 -0.26 0.00 0.00 -0.67 0.00 0.00 178.83 177.39 1req n GLN 577 N -4.20 -0.35 0.06 1.46 10.64 -0.34 -4.78 117.38 119.87 1req n GLN 577 Ca -0.05 -0.76 -0.09 0.00 -1.83 0.00 0.00 57.00 54.26 1req n GLN 577 Cb 0.16 -1.07 -0.06 0.00 -0.86 0.00 0.00 30.24 28.41 1req n GLN 577 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.06 176.01 1req h GLY 578 N 0.74 -1.20 0.11 2.61 0.00 -1.07 0.13 103.07 104.38 1req h GLY 578 Ca 0.00 0.61 0.05 0.00 0.00 0.00 0.00 47.33 47.99 1req h GLY 578 CO 0.00 -0.35 -0.34 -2.00 0.00 0.00 0.00 176.54 173.84 1req h LEU 579 N -0.43 -1.07 -1.06 3.11 5.85 -1.87 -1.00 115.31 118.85 1req h LEU 579 Ca -0.00 0.15 0.20 0.00 0.84 0.00 0.00 57.88 59.08 1req h LEU 579 Cb 0.44 0.45 -0.11 0.00 0.37 0.00 0.00 40.66 41.81 1req h LEU 579 CO -0.18 -0.37 0.61 -0.08 -0.34 0.00 0.00 178.44 178.08 1req h GLU 580 N -0.41 0.68 -0.07 1.25 4.81 -1.87 -0.33 114.58 118.64 1req h GLU 580 Ca 0.10 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.22 1req h GLU 580 Cb 0.57 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1req h GLU 580 CO -0.37 0.45 -0.22 0.28 -0.73 0.00 0.00 179.01 178.42 1req h VAL 581 N 0.70 1.43 -0.47 0.32 2.07 0.03 -2.74 116.25 117.59 1req h VAL 581 Ca 0.58 -1.60 0.09 0.00 0.82 0.00 0.00 66.70 66.60 1req h VAL 581 Cb 1.00 2.29 -0.09 0.00 -1.52 0.00 0.00 31.29 32.96 1req h VAL 581 CO -0.38 0.45 -0.13 0.00 0.02 0.00 0.00 177.57 177.53 1req h ALA 582 N 0.45 0.28 0.26 1.67 0.00 -0.69 0.26 119.26 121.49 1req h ALA 582 Ca -0.01 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1req h ALA 582 Cb 0.84 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 1req h ALA 582 CO 0.05 -0.46 -0.23 0.87 0.00 0.00 0.00 179.25 179.47 1req h LYS 583 N -0.02 -0.50 -0.62 0.00 1.57 -1.17 -1.11 116.57 114.71 1req h LYS 583 Ca 0.23 0.03 0.06 0.00 -1.87 0.00 0.00 60.65 59.09 1req h LYS 583 Cb 0.36 0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.73 1req h LYS 583 CO -0.49 -0.33 0.34 0.00 -0.57 0.00 0.00 179.45 178.39 1req h ALA 584 N 0.16 0.83 -0.17 3.86 0.00 -1.11 0.42 119.26 123.25 1req h ALA 584 Ca -0.01 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1req h ALA 584 Cb 0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1req h ALA 584 CO -0.04 0.01 0.05 -0.07 0.00 0.00 0.00 179.25 179.20 1req h LEU 585 N 0.63 0.04 -0.40 0.00 3.38 -0.35 -0.13 115.31 118.49 1req h LEU 585 Ca 0.28 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.34 1req h LEU 585 Cb 0.18 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.88 1req h LEU 585 CO -0.18 0.05 0.00 0.11 0.09 0.00 0.00 178.44 178.51 1req h LYS 586 N 0.12 0.10 -0.54 1.13 1.79 -0.42 -2.73 116.57 116.02 1req h LYS 586 Ca 0.07 -0.01 0.10 0.00 -2.18 0.00 0.00 60.65 58.64 1req h LYS 586 Cb 0.05 -0.02 -0.08 0.00 -1.58 0.00 0.00 32.23 30.60 1req h LYS 586 CO -0.09 0.07 0.07 0.00 -1.08 0.00 0.00 179.45 178.42 1req h ALA 587 N 1.35 0.58 0.00 3.86 0.00 0.24 -1.28 119.26 124.01 1req h ALA 587 Ca 0.19 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1req h ALA 587 Cb 0.27 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1req h ALA 587 CO -0.32 -0.34 0.00 0.00 0.00 0.00 0.00 179.25 178.58 1req n ALA 588 N -2.62 1.85 0.00 0.00 0.00 -0.10 -4.83 120.51 114.80 1req n ALA 588 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1req n ALA 588 Cb 0.29 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1req n ALA 588 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1req n GLY 589 N -0.10 0.68 3.63 0.00 0.00 -0.48 -4.98 105.19 103.95 1req n GLY 589 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1req n GLY 589 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req s ALA 590 N -2.00 3.18 0.11 4.61 0.00 -1.16 -4.88 121.76 121.62 1req s ALA 590 Ca 0.00 1.07 -0.20 0.00 0.00 0.00 0.00 51.96 52.83 1req s ALA 590 Cb 0.00 -3.96 -0.08 0.00 0.00 0.00 0.00 23.12 19.08 1req s ALA 590 CO 0.00 -2.16 1.76 0.87 0.00 0.00 0.00 175.76 176.24 1req h LYS 591 N 12.73 0.22 -3.92 0.00 1.57 -1.13 -3.45 116.57 122.59 1req h LYS 591 Ca -0.46 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.19 1req h LYS 591 Cb 1.24 -0.05 -0.16 0.00 0.08 0.00 0.00 32.23 33.34 1req h LYS 591 CO 0.95 0.16 -0.53 0.00 -0.57 0.00 0.00 179.45 179.46 1req s ALA 592 N -6.13 0.05 -0.06 3.86 0.00 -1.20 -5.05 121.76 113.23 1req s ALA 592 Ca -0.13 -0.74 0.02 0.00 0.00 0.00 0.00 51.96 51.11 1req s ALA 592 Cb 0.08 0.31 0.02 0.00 0.00 0.00 0.00 23.12 23.52 1req s ALA 592 CO 0.69 -0.37 -0.08 -0.51 0.00 0.00 0.00 175.76 175.48 1req s LEU 593 N -2.48 1.48 0.16 0.00 1.43 -1.26 -2.01 118.68 116.00 1req s LEU 593 Ca 0.00 -0.22 0.06 0.00 -1.03 0.00 0.00 54.13 52.94 1req s LEU 593 Cb 0.02 -0.64 -0.04 0.00 0.03 0.00 0.00 46.19 45.56 1req s LEU 593 CO -0.07 -0.01 0.10 -0.31 0.23 0.00 0.00 176.35 176.28 1req s TYR 594 N 0.81 3.06 -0.18 0.29 1.51 0.67 -1.11 117.35 122.41 1req s TYR 594 Ca -0.12 -0.05 -0.02 0.00 -1.01 0.00 0.00 57.07 55.86 1req s TYR 594 Cb -0.15 -1.48 -0.01 0.00 -0.11 0.00 0.00 41.96 40.21 1req s TYR 594 CO 0.02 0.52 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.73 1req s LEU 595 N -3.04 2.86 -0.89 -1.29 2.96 -0.58 -0.37 118.68 118.33 1req s LEU 595 Ca 0.30 -0.34 -0.22 0.00 -0.22 0.00 0.00 54.13 53.65 1req s LEU 595 Cb -0.10 -1.69 0.08 0.00 0.50 0.00 0.00 46.19 44.98 1req s LEU 595 CO 0.22 0.07 1.22 -0.44 -1.32 0.00 0.00 176.35 176.09 1req s SER 596 N 0.95 6.46 0.00 3.68 0.01 -0.02 -0.40 113.70 124.38 1req s SER 596 Ca -0.01 -1.52 0.00 0.00 1.31 0.00 0.00 55.95 55.73 1req s SER 596 Cb -0.15 -2.47 0.00 0.00 0.21 0.00 0.00 66.02 63.61 1req s SER 596 CO 0.00 -1.35 0.00 0.61 0.41 0.00 0.00 173.24 172.92 1req n GLY 597 N 5.91 0.97 3.56 3.44 0.00 -0.40 -4.58 105.19 114.07 1req n GLY 597 Ca 0.20 -1.90 -0.28 0.00 0.00 0.00 0.00 46.02 44.04 1req n GLY 597 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req s ALA 598 N -1.03 2.90 0.41 4.61 0.00 -1.26 -4.59 121.76 122.81 1req s ALA 598 Ca 0.00 -1.40 0.08 0.00 0.00 0.00 0.00 51.96 50.65 1req s ALA 598 Cb 0.00 -0.76 0.88 0.00 0.00 0.00 0.00 23.12 23.24 1req s ALA 598 CO 0.00 0.53 2.03 0.74 0.00 0.00 0.00 175.76 179.06 1req h PHE 599 N 3.22 0.40 -0.68 0.00 0.04 -1.98 -2.63 116.94 115.30 1req h PHE 599 Ca -0.48 -0.00 0.20 0.00 2.80 0.00 0.00 57.97 60.49 1req h PHE 599 Cb 1.19 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 39.18 1req h PHE 599 CO 0.63 0.31 0.50 0.87 -0.60 0.00 0.00 178.31 180.01 1req h LYS 600 N 0.41 0.00 0.00 1.51 6.56 -1.93 -2.04 116.57 121.08 1req h LYS 600 Ca 0.11 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.70 1req h LYS 600 Cb 0.06 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.72 1req h LYS 600 CO -0.01 0.00 0.00 0.39 -2.06 0.00 0.00 179.45 177.77 1req n GLU 601 N -4.31 0.13 -0.06 3.15 1.02 -0.99 -1.89 120.64 117.68 1req n GLU 601 Ca 0.13 0.46 0.11 0.00 -0.02 0.00 0.00 57.16 57.84 1req n GLU 601 Cb 0.76 -1.80 0.42 0.00 -0.02 0.00 0.00 31.44 30.81 1req n GLU 601 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1req n PHE 602 N -2.05 0.16 0.00 -0.32 3.01 -0.77 -2.70 117.46 114.79 1req n PHE 602 Ca 0.01 -0.08 0.00 0.00 1.01 0.00 0.00 57.45 58.39 1req n PHE 602 Cb 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.61 1req n PHE 602 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1req n GLY 603 N 1.11 1.34 0.16 1.37 0.00 -0.79 -1.70 105.19 106.68 1req n GLY 603 Ca 0.17 0.41 0.12 0.00 0.00 0.00 0.00 46.02 46.72 1req n GLY 603 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1req h ASP 604 N 0.00 0.00 -0.18 1.61 5.19 -1.94 -2.99 116.42 118.10 1req h ASP 604 Ca 0.00 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 1req h ASP 604 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1req h ASP 604 CO 0.00 0.00 0.00 0.47 -3.12 0.00 0.00 179.24 176.59 1req n ASP 605 N -2.70 1.77 -0.05 6.45 8.00 -0.69 -4.48 116.55 124.85 1req n ASP 605 Ca 0.04 -1.74 -0.08 0.00 0.71 0.00 0.00 54.79 53.73 1req n ASP 605 Cb 0.49 -0.12 -0.02 0.00 -0.02 0.00 0.00 41.12 41.45 1req n ASP 605 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1req h ALA 606 N 4.06 -0.11 -0.00 2.24 0.00 -1.61 -0.57 119.26 123.26 1req h ALA 606 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1req h ALA 606 Cb 0.51 0.50 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1req h ALA 606 CO 0.00 -0.66 -0.01 0.00 0.00 0.00 0.00 179.25 178.58 1req h ALA 607 N 0.82 -0.01 -0.53 0.00 0.00 -1.85 -1.08 119.26 116.60 1req h ALA 607 Ca 0.14 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1req h ALA 607 Cb 0.45 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1req h ALA 607 CO -0.39 -0.51 0.01 1.05 0.00 0.00 0.00 179.25 179.41 1req h GLU 608 N -0.02 0.90 0.15 0.00 4.11 -1.83 -3.08 114.58 114.80 1req h GLU 608 Ca 0.01 -0.25 -0.01 0.00 0.07 0.00 0.00 59.36 59.18 1req h GLU 608 Cb 0.03 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1req h GLU 608 CO -0.01 0.88 -0.07 0.00 0.07 0.00 0.00 179.01 179.88 1req h ALA 609 N 1.18 -0.20 -0.97 1.06 0.00 -0.87 -3.15 119.26 116.31 1req h ALA 609 Ca 0.16 -0.05 0.18 0.00 0.00 0.00 0.00 54.91 55.21 1req h ALA 609 Cb 0.48 0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.24 1req h ALA 609 CO 0.02 -0.61 0.56 1.05 0.00 0.00 0.00 179.25 180.27 1req h GLU 610 N -0.20 0.69 -0.22 0.00 -0.00 -1.12 -0.76 114.58 112.97 1req h GLU 610 Ca -0.02 -0.04 0.06 0.00 -0.00 0.00 0.00 59.36 59.36 1req h GLU 610 Cb 0.16 -0.16 -0.01 0.00 -0.00 0.00 0.00 28.75 28.74 1req h GLU 610 CO 0.03 0.46 0.18 1.57 -0.00 0.00 0.00 179.01 181.25 1req h LYS 611 N 0.71 0.00 0.00 1.06 2.10 -1.52 -2.71 116.57 116.21 1req h LYS 611 Ca 0.56 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 59.10 1req h LYS 611 Cb 0.87 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.18 1req h LYS 611 CO -0.39 0.00 -1.11 -0.07 -2.00 0.00 0.00 179.45 175.87 1req h LEU 612 N 0.00 0.00 -9.16 7.07 3.38 -1.19 -3.48 115.31 111.93 1req h LEU 612 Ca 0.11 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.46 1req h LEU 612 Cb 0.46 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.07 1req h LEU 612 CO -0.00 0.40 -0.50 -0.63 0.09 0.00 0.00 178.44 177.79 1req s ILE 613 N -3.05 5.33 -0.15 1.22 1.01 -1.02 -4.46 121.20 120.07 1req s ILE 613 Ca -0.01 0.17 0.15 0.00 0.00 0.00 0.00 60.65 60.96 1req s ILE 613 Cb 0.09 -3.46 0.03 0.00 0.01 0.00 0.00 42.46 39.13 1req s ILE 613 CO 0.79 0.39 1.36 0.44 0.00 0.00 0.00 174.94 177.92 1req h ASP 614 N 7.10 0.00 -5.32 3.58 5.19 -1.40 -3.47 116.42 122.10 1req h ASP 614 Ca -0.39 0.00 0.33 0.00 -0.62 0.00 0.00 57.03 56.34 1req h ASP 614 Cb 1.16 0.00 -0.15 0.00 0.18 0.00 0.00 39.33 40.52 1req h ASP 614 CO 0.70 0.51 0.87 -0.83 -3.12 0.00 0.00 179.24 177.37 1req s GLY 615 N -4.50 -0.39 0.16 2.75 0.00 -1.23 -5.04 107.32 99.06 1req s GLY 615 Ca 0.03 1.06 0.09 0.00 0.00 0.00 0.00 44.72 45.90 1req s GLY 615 CO 0.76 0.27 -0.20 0.50 0.00 0.00 0.00 173.10 174.42 1req s ARG 616 N -2.31 1.31 -0.17 2.90 0.52 -1.26 -1.53 118.95 118.41 1req s ARG 616 Ca 0.13 -1.39 -0.04 0.00 -0.52 0.00 0.00 55.73 53.92 1req s ARG 616 Cb 0.04 -1.48 -0.02 0.00 0.52 0.00 0.00 34.95 34.01 1req s ARG 616 CO -0.04 0.31 -0.03 -0.51 0.02 0.00 0.00 175.30 175.05 1req s LEU 617 N -2.51 3.19 0.04 2.53 1.43 0.47 -4.92 118.68 118.91 1req s LEU 617 Ca 0.15 -0.18 -0.27 0.00 -1.03 0.00 0.00 54.13 52.80 1req s LEU 617 Cb -0.07 -1.78 0.07 0.00 0.03 0.00 0.00 46.19 44.44 1req s LEU 617 CO 0.07 0.13 0.63 0.72 0.23 0.00 0.00 176.35 178.12 1req s PHE 618 N 0.61 -0.58 0.20 0.29 -0.71 -1.26 -1.28 117.98 115.25 1req s PHE 618 Ca -0.02 0.75 -0.32 0.00 -1.04 0.00 0.00 56.93 56.31 1req s PHE 618 Cb -0.14 0.45 -0.11 0.00 -1.21 0.00 0.00 43.02 42.01 1req s PHE 618 CO 0.02 -0.69 1.63 1.41 -1.34 0.00 0.00 175.22 176.25 1req s MET 619 N -2.24 4.17 0.00 1.99 -2.45 -1.26 -2.16 119.30 117.35 1req s MET 619 Ca -0.06 2.47 0.00 0.00 -1.25 0.00 0.00 55.69 56.85 1req s MET 619 Cb -0.00 -3.11 0.00 0.00 1.25 0.00 0.00 34.83 32.97 1req s MET 619 CO 0.00 -0.66 0.00 0.41 1.05 0.00 0.00 175.02 175.83 1req n GLY 620 N 3.65 0.12 3.63 2.11 0.00 -1.26 -5.07 105.19 108.37 1req n GLY 620 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1req n GLY 620 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1req n MET 621 N -2.00 -0.36 -2.81 1.61 3.85 -0.92 -4.74 117.12 111.76 1req n MET 621 Ca 0.00 -0.04 -0.43 0.00 -1.00 0.00 0.00 57.70 56.23 1req n MET 621 Cb 0.00 -2.29 -0.04 0.00 -1.05 0.00 0.00 33.22 29.84 1req n MET 621 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1req s ASP 622 N -2.47 6.66 0.17 3.17 -1.08 -1.26 -4.02 116.67 117.84 1req s ASP 622 Ca 0.66 0.54 0.03 0.00 -0.52 0.00 0.00 52.55 53.26 1req s ASP 622 Cb -0.23 -2.46 0.02 0.00 -1.46 0.00 0.00 42.92 38.78 1req s ASP 622 CO 0.59 -0.87 1.39 -0.37 0.52 0.00 0.00 175.17 176.43 1req h VAL 623 N 5.84 1.49 0.13 1.11 -1.51 -0.16 -2.83 116.25 120.31 1req h VAL 623 Ca -0.23 -2.57 -0.01 0.00 -1.23 0.00 0.00 66.70 62.66 1req h VAL 623 Cb 1.08 2.43 0.00 0.00 -2.13 0.00 0.00 31.29 32.67 1req h VAL 623 CO 0.98 0.75 -0.06 0.58 -1.23 0.00 0.00 177.57 178.59 1req h VAL 624 N 0.11 0.94 -0.16 7.19 2.07 -1.90 -0.38 116.25 124.11 1req h VAL 624 Ca -0.04 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 67.27 1req h VAL 624 Cb 1.47 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 32.30 1req h VAL 624 CO 0.13 0.06 -0.08 -0.78 0.02 0.00 0.00 177.57 176.92 1req h ASP 625 N -0.29 -0.28 0.04 0.57 3.58 -1.90 -0.58 116.42 117.56 1req h ASP 625 Ca -0.02 0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.50 1req h ASP 625 Cb 0.23 0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.44 1req h ASP 625 CO 0.03 -0.11 -0.02 0.74 -2.88 0.00 0.00 179.24 177.00 1req h THR 626 N -0.07 1.01 -0.39 2.25 2.02 -1.48 -2.49 112.91 113.76 1req h THR 626 Ca 0.09 -0.15 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 1req h THR 626 Cb 0.21 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1req h THR 626 CO -0.21 0.04 0.18 -0.07 0.37 0.00 0.00 175.52 175.83 1req h LEU 627 N -0.12 0.52 -1.02 2.58 3.38 -0.82 -0.95 115.31 118.89 1req h LEU 627 Ca -0.01 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 1req h LEU 627 Cb 0.10 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1req h LEU 627 CO 0.01 0.51 0.24 0.77 0.09 0.00 0.00 178.44 180.06 1req h SER 628 N 0.49 0.87 -0.70 -0.43 4.64 -1.11 -1.28 113.55 116.02 1req h SER 628 Ca 0.13 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1req h SER 628 Cb 0.14 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 61.97 1req h SER 628 CO -0.02 0.79 0.32 -1.28 -0.87 0.00 0.00 176.83 175.77 1req h SER 629 N 0.92 0.95 -0.44 4.97 0.87 -1.40 -1.49 113.55 117.94 1req h SER 629 Ca 0.21 -0.12 -0.11 0.00 -1.23 0.00 0.00 61.79 60.55 1req h SER 629 Cb 0.20 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 1req h SER 629 CO -0.02 0.82 -0.14 0.74 -0.53 0.00 0.00 176.83 177.71 1req h THR 630 N 1.03 1.27 -0.27 2.23 2.02 -0.20 -0.87 112.91 118.13 1req h THR 630 Ca 0.25 -1.27 -0.00 0.00 0.77 0.00 0.00 66.41 66.16 1req h THR 630 Cb 0.14 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1req h THR 630 CO -0.03 0.43 0.16 -0.07 0.37 0.00 0.00 175.52 176.39 1req h LEU 631 N 0.71 0.32 -0.01 2.58 3.38 -1.15 0.04 115.31 121.17 1req h LEU 631 Ca 0.11 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1req h LEU 631 Cb 0.69 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 1req h LEU 631 CO 0.05 0.27 -0.47 0.44 0.09 0.00 0.00 178.44 178.81 1req h ASP 632 N 0.34 -1.47 -0.89 -0.43 3.32 -0.91 -1.91 116.42 114.48 1req h ASP 632 Ca 0.10 0.16 0.21 0.00 0.02 0.00 0.00 57.03 57.52 1req h ASP 632 Cb 0.01 0.56 -0.12 0.00 0.22 0.00 0.00 39.33 39.99 1req h ASP 632 CO -0.02 -0.46 0.39 0.40 -1.72 0.00 0.00 179.24 177.84 1req h ILE 633 N -0.58 0.51 0.00 0.35 2.04 -1.02 0.16 117.51 118.97 1req h ILE 633 Ca 0.01 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1req h ILE 633 Cb 0.63 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1req h ILE 633 CO -0.32 0.08 0.00 0.18 0.00 0.00 0.00 178.15 178.09 1req n LEU 634 N -5.02 0.00 -2.20 1.44 4.77 -0.01 -4.87 117.00 111.11 1req n LEU 634 Ca 0.21 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.09 1req n LEU 634 Cb 0.62 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.75 1req n LEU 634 CO 0.14 0.00 0.09 0.61 -1.33 0.00 0.00 177.39 176.90 1req n GLY 635 N 0.06 0.09 3.68 -0.72 0.00 0.55 -5.01 105.19 103.83 1req n GLY 635 Ca 0.11 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 1req n GLY 635 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1req s VAL 636 N -3.18 4.93 1.03 1.61 1.01 -0.75 -5.05 120.40 120.00 1req s VAL 636 Ca 0.13 0.01 -0.17 0.00 0.00 0.00 0.00 61.98 61.95 1req s VAL 636 Cb -0.06 -3.20 0.02 0.00 0.00 0.00 0.00 36.38 33.14 1req s VAL 636 CO 0.38 0.49 -0.10 0.00 0.00 0.00 0.00 175.10 175.87 1req n ALA 637 N 3.22 -3.90 -0.50 5.51 0.00 -1.26 -4.52 120.51 119.07 1req n ALA 637 Ca -0.17 -0.97 0.00 0.00 0.00 0.00 0.00 53.44 52.30 1req n ALA 637 Cb 0.53 -1.51 0.00 0.00 0.00 0.00 0.00 19.45 18.47 1req n ALA 637 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86