#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1req s LEU 21 N 0.00 4.36 -0.21 3.22 2.96 -1.26 -4.95 118.68 122.80 1req s LEU 21 Ca 0.00 2.39 -0.20 0.00 -0.22 0.00 0.00 54.13 56.10 1req s LEU 21 Cb 0.00 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.13 1req s LEU 21 CO 0.00 -0.96 0.60 -0.55 -1.32 0.00 0.00 176.35 174.12 1req s SER 22 N 3.56 6.62 0.00 3.68 0.15 -1.26 -4.95 113.70 121.51 1req s SER 22 Ca 0.78 0.76 0.00 0.00 0.70 0.00 0.00 55.95 58.18 1req s SER 22 Cb -0.37 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.61 1req s SER 22 CO 0.33 -0.28 0.00 0.18 1.20 0.00 0.00 173.24 174.67 1req n LEU 23 N 5.18 0.00 0.24 3.45 4.77 -1.26 -4.74 117.00 124.63 1req n LEU 23 Ca -0.02 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.08 1req n LEU 23 Cb 0.50 -0.02 0.54 0.00 -2.33 0.00 0.00 43.42 42.11 1req n LEU 23 CO 0.43 -0.30 0.86 0.00 -1.33 0.00 0.00 177.39 177.05 1req h ALA 24 N -0.16 1.06 0.00 -1.18 0.00 -1.95 -2.98 119.26 114.04 1req h ALA 24 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1req h ALA 24 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1req h ALA 24 CO 0.00 0.22 0.00 0.41 0.00 0.00 0.00 179.25 179.88 1req n GLY 25 N -0.01 -0.71 0.05 0.00 0.00 -1.26 -2.66 105.19 100.60 1req n GLY 25 Ca -0.00 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.08 1req n GLY 25 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1req n ASP 26 N -1.26 0.38 -4.46 1.61 9.92 -1.13 -4.86 116.55 116.77 1req n ASP 26 Ca 0.07 0.54 -0.23 0.00 -0.53 0.00 0.00 54.79 54.64 1req n ASP 26 Cb 0.10 -0.64 -0.10 0.00 -0.64 0.00 0.00 41.12 39.84 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 -3.06 2.23 0.54 1.24 0.08 -1.09 -5.13 117.98 112.79 1req s PHE 27 Ca 0.12 -0.36 -0.21 0.00 0.12 0.00 0.00 56.93 56.60 1req s PHE 27 Cb 0.15 -0.97 -0.06 0.00 -0.57 0.00 0.00 43.02 41.57 1req s PHE 27 CO 0.54 0.68 1.13 -2.30 -0.10 0.00 0.00 175.22 175.18 1req n PRO 28 N -0.59 1.33 -1.92 0.24 -0.02 -1.26 -4.83 135.00 127.94 1req n PRO 28 Ca -0.05 0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 61.49 1req n PRO 28 Cb 0.60 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.75 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 -2.63 3.50 0.42 -0.52 0.00 -1.26 -4.94 119.74 114.31 1req s LYS 29 Ca 0.71 1.72 -0.24 0.00 0.00 0.00 0.00 55.97 58.16 1req s LYS 29 Cb -0.45 -4.18 -0.08 0.00 0.00 0.00 0.00 37.83 33.12 1req s LYS 29 CO 0.50 -1.66 1.17 0.00 0.00 0.00 0.00 175.35 175.36 1req s ALA 30 N 6.47 3.10 0.29 0.59 0.00 -1.26 -5.04 121.76 125.91 1req s ALA 30 Ca 0.82 0.95 0.10 0.00 0.00 0.00 0.00 51.96 53.83 1req s ALA 30 Cb -0.27 -3.38 -0.06 0.00 0.00 0.00 0.00 23.12 19.41 1req s ALA 30 CO 0.33 -0.56 -0.13 0.95 0.00 0.00 0.00 175.76 176.35 1req s THR 31 N -1.46 2.15 0.20 0.00 -4.23 -1.26 -5.06 115.64 105.98 1req s THR 31 Ca 0.59 -2.26 -0.11 0.00 -1.18 0.00 0.00 61.69 58.73 1req s THR 31 Cb -0.30 -2.42 0.13 0.00 1.34 0.00 0.00 72.50 71.25 1req s THR 31 CO 0.37 -0.34 1.75 -0.08 -0.54 0.00 0.00 174.62 175.79 1req h GLU 32 N 2.22 0.41 -0.73 3.99 4.57 -1.99 -2.32 114.58 120.72 1req h GLU 32 Ca -0.40 -0.02 0.03 0.00 -1.18 0.00 0.00 59.36 57.78 1req h GLU 32 Cb 1.25 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 29.70 1req h GLU 32 CO 0.65 0.27 0.46 0.93 -1.18 0.00 0.00 179.01 180.15 1req h GLU 33 N 0.42 0.87 -0.56 1.92 4.39 -1.98 0.12 114.58 119.77 1req h GLU 33 Ca 0.28 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.90 1req h GLU 33 Cb 0.31 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 1req h GLU 33 CO -0.27 0.58 0.25 1.96 -1.16 0.00 0.00 179.01 180.37 1req h GLN 34 N 0.90 0.82 -0.51 2.33 4.20 -1.91 -0.95 115.11 119.99 1req h GLN 34 Ca 0.30 -0.13 -0.10 0.00 0.06 0.00 0.00 58.65 58.77 1req h GLN 34 Cb 0.02 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1req h GLN 34 CO -0.11 0.69 -0.07 2.35 -0.67 0.00 0.00 178.83 181.02 1req h TRP 35 N 0.76 1.06 -0.61 2.96 7.01 -0.84 -1.09 115.95 125.20 1req h TRP 35 Ca 0.19 -0.21 0.04 0.00 2.11 0.00 0.00 58.89 61.03 1req h TRP 35 Cb 0.15 -0.27 -0.05 0.00 -2.10 0.00 0.00 29.16 26.90 1req h TRP 35 CO 0.00 0.99 0.35 0.93 -2.79 0.00 0.00 178.44 177.92 1req h GLU 36 N 0.82 0.65 -0.95 2.65 5.08 -0.61 0.19 114.58 122.40 1req h GLU 36 Ca 0.14 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1req h GLU 36 Cb 0.62 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.67 1req h GLU 36 CO 0.04 0.43 0.63 0.00 -1.00 0.00 0.00 179.01 179.11 1req h ARG 37 N 0.67 1.24 -0.41 2.33 3.08 -0.89 -1.79 114.38 118.60 1req h ARG 37 Ca 0.26 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.17 1req h ARG 37 Cb 0.11 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1req h ARG 37 CO -0.15 0.82 -0.04 0.93 -1.07 0.00 0.00 179.97 180.46 1req h GLU 38 N 1.28 0.68 -0.35 0.04 4.39 -0.60 -1.30 114.58 118.72 1req h GLU 38 Ca 0.35 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 1req h GLU 38 Cb -0.13 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.42 1req h GLU 38 CO -0.08 0.73 0.18 0.28 -1.16 0.00 0.00 179.01 178.96 1req h VAL 39 N 0.64 1.15 -0.04 3.13 2.07 -0.04 -2.93 116.25 120.23 1req h VAL 39 Ca 0.12 -0.42 0.02 0.00 0.82 0.00 0.00 66.70 67.25 1req h VAL 39 Cb 0.46 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1req h VAL 39 CO 0.02 0.16 -0.11 -0.33 0.02 0.00 0.00 177.57 177.33 1req h GLU 40 N 0.43 -0.16 -0.68 1.57 5.08 -1.16 -1.51 114.58 118.16 1req h GLU 40 Ca 0.12 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.62 1req h GLU 40 Cb 0.09 0.04 -0.13 0.00 0.50 0.00 0.00 28.75 29.25 1req h GLU 40 CO -0.02 -0.11 -0.22 0.87 -1.00 0.00 0.00 179.01 178.54 1req h LYS 41 N -0.17 -0.04 -0.31 2.33 1.57 -1.15 0.41 116.57 119.22 1req h LYS 41 Ca 0.05 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.77 1req h LYS 41 Cb 0.24 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1req h LYS 41 CO -0.13 -0.03 -0.05 0.28 -0.57 0.00 0.00 179.45 178.95 1req h VAL 42 N -0.04 1.27 0.00 0.50 2.07 -1.25 -2.96 116.25 115.85 1req h VAL 42 Ca 0.31 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1req h VAL 42 Cb 0.52 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1req h VAL 42 CO -0.72 0.34 -0.09 -0.07 0.02 0.00 0.00 177.57 177.06 1req h LEU 43 N 0.36 0.00 0.00 2.57 4.07 -0.89 -3.00 115.31 118.41 1req h LEU 43 Ca 0.08 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.02 1req h LEU 43 Cb 0.53 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.27 1req h LEU 43 CO 0.03 0.01 -0.04 0.59 -1.08 0.00 0.00 178.44 177.95 1req n ASN 44 N -2.48 0.31 -0.03 -0.43 3.02 0.10 -4.70 115.26 111.05 1req n ASN 44 Ca 0.05 0.48 -0.01 0.00 -0.03 0.00 0.00 54.58 55.07 1req n ASN 44 Cb 0.46 -0.55 -0.01 0.00 -0.61 0.00 0.00 39.78 39.08 1req n ASN 44 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1req n ARG 45 N -1.77 -0.03 -1.79 3.52 1.74 -1.12 -1.64 116.66 115.57 1req n ARG 45 Ca 0.06 0.28 -0.24 0.00 -0.77 0.00 0.00 57.85 57.19 1req n ARG 45 Cb 0.37 -0.42 0.05 0.00 -1.02 0.00 0.00 32.46 31.44 1req n ARG 45 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1req n GLY 46 N -1.02 6.20 3.75 -0.13 0.00 -1.26 -4.98 105.19 107.76 1req n GLY 46 Ca 0.00 -2.49 -0.37 0.00 0.00 0.00 0.00 46.02 43.16 1req n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1req s ARG 47 N -3.61 4.18 0.80 1.61 0.52 -0.65 -5.05 118.95 116.75 1req s ARG 47 Ca 0.53 0.24 -0.14 0.00 -0.52 0.00 0.00 55.73 55.84 1req s ARG 47 Cb 0.43 -3.38 0.06 0.00 0.52 0.00 0.00 34.95 32.58 1req s ARG 47 CO 0.03 0.32 1.10 -0.35 0.02 0.00 0.00 175.30 176.41 1req n PRO 48 N 3.23 0.22 0.08 3.54 -0.04 -1.26 -4.84 135.00 135.93 1req n PRO 48 Ca -0.11 0.15 0.20 0.00 -0.04 0.00 0.00 63.50 63.69 1req n PRO 48 Cb 0.52 -2.35 0.63 0.00 -0.04 0.00 0.00 33.50 32.26 1req n PRO 48 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1req h PRO 49 N -0.80 0.00 -0.57 0.54 0.11 -1.97 0.22 132.00 129.53 1req h PRO 49 Ca -0.46 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 65.26 1req h PRO 49 Cb 1.31 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 32.16 1req h PRO 49 CO 0.45 0.00 -0.31 0.39 -0.21 0.00 0.00 178.00 178.33 1req n GLU 50 N -3.35 2.66 -0.86 1.05 -0.58 -1.26 -4.56 120.64 113.75 1req n GLU 50 Ca 0.09 -3.63 0.03 0.00 -0.42 0.00 0.00 57.16 53.23 1req n GLU 50 Cb 0.82 -2.05 0.04 0.00 -0.57 0.00 0.00 31.44 29.68 1req n GLU 50 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1req n LYS 51 N -0.92 0.25 -2.35 3.49 4.01 0.77 -5.09 118.16 118.32 1req n LYS 51 Ca 0.40 -1.72 -0.42 0.00 -0.51 0.00 0.00 58.31 56.06 1req n LYS 51 Cb 0.91 -0.49 -0.03 0.00 -0.51 0.00 0.00 35.03 34.91 1req n LYS 51 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 1req s GLN 52 N -0.53 4.41 0.01 1.97 -1.52 -1.24 -4.73 119.66 118.03 1req s GLN 52 Ca 0.19 1.86 -0.18 0.00 -1.95 0.00 0.00 55.36 55.29 1req s GLN 52 Cb 0.21 -3.31 -0.06 0.00 -0.22 0.00 0.00 33.01 29.63 1req s GLN 52 CO -0.07 -0.28 0.51 -0.51 -0.25 0.00 0.00 175.29 174.69 1req s LEU 53 N 0.89 4.46 0.79 2.90 1.43 -1.26 -5.09 118.68 122.79 1req s LEU 53 Ca 0.59 1.09 -0.10 0.00 -1.03 0.00 0.00 54.13 54.68 1req s LEU 53 Cb -0.32 -2.77 0.09 0.00 0.03 0.00 0.00 46.19 43.22 1req s LEU 53 CO 0.30 0.22 1.14 0.42 0.23 0.00 0.00 176.35 178.67 1req s THR 54 N -0.70 2.10 0.15 5.49 -4.23 -1.26 -4.86 115.64 112.33 1req s THR 54 Ca 0.27 -0.11 -0.16 0.00 -1.18 0.00 0.00 61.69 60.51 1req s THR 54 Cb -0.18 -2.99 0.02 0.00 1.34 0.00 0.00 72.50 70.70 1req s THR 54 CO 0.16 0.00 1.77 0.15 -0.54 0.00 0.00 174.62 176.15 1req h PHE 55 N -0.97 0.30 -0.81 3.99 3.57 -1.99 -1.56 116.94 119.48 1req h PHE 55 Ca -0.45 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.18 1req h PHE 55 Cb 1.31 -0.08 -0.08 0.00 2.79 0.00 0.00 35.95 39.89 1req h PHE 55 CO 0.11 0.15 0.42 0.00 -2.23 0.00 0.00 178.31 176.76 1req h ALA 56 N 1.21 1.17 -0.40 2.41 0.00 -1.98 0.46 119.26 122.12 1req h ALA 56 Ca 0.16 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1req h ALA 56 Cb 0.10 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1req h ALA 56 CO -0.13 -0.02 0.20 0.93 0.00 0.00 0.00 179.25 180.22 1req h GLU 57 N 0.67 0.57 -0.46 0.00 5.08 -1.82 -2.34 114.58 116.28 1req h GLU 57 Ca 0.41 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.70 1req h GLU 57 Cb 0.49 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1req h GLU 57 CO -0.30 0.49 0.29 0.00 -1.00 0.00 0.00 179.01 178.49 1req h LEU 59 N 0.59 0.50 -0.90 0.00 5.85 -0.07 -0.91 115.31 120.38 1req h LEU 59 Ca 0.18 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 1req h LEU 59 Cb -0.03 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 1req h LEU 59 CO -0.06 0.30 0.38 0.50 -0.34 0.00 0.00 178.44 179.22 1req h LYS 60 N 0.64 1.18 0.00 1.25 3.64 -1.29 -1.55 116.57 120.43 1req h LYS 60 Ca 0.33 -0.18 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1req h LYS 60 Cb 0.29 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1req h LYS 60 CO -0.23 0.91 -0.14 0.00 -2.27 0.00 0.00 179.45 177.72 1req h ARG 61 N 1.16 0.00 -0.17 1.90 3.08 -0.64 -2.75 114.38 116.95 1req h ARG 61 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 1req h ARG 61 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1req h ARG 61 CO -0.03 0.14 0.00 1.28 -1.07 0.00 0.00 179.97 180.29 1req n LEU 62 N -3.47 2.20 -4.72 3.04 4.77 -0.42 -4.89 117.00 113.51 1req n LEU 62 Ca -0.01 -0.88 -0.41 0.00 -0.03 0.00 0.00 56.01 54.69 1req n LEU 62 Cb 0.30 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.24 1req n LEU 62 CO 0.30 0.44 0.52 -0.89 -1.33 0.00 0.00 177.39 176.43 1req s THR 63 N -1.78 4.91 -0.14 -5.08 2.01 -0.82 -4.10 115.64 110.63 1req s THR 63 Ca 0.34 1.72 -0.06 0.00 0.31 0.00 0.00 61.69 64.00 1req s THR 63 Cb 0.20 -4.16 -0.04 0.00 0.01 0.00 0.00 72.50 68.50 1req s THR 63 CO 0.29 0.24 0.08 -0.69 -0.69 0.00 0.00 174.62 173.85 1req s VAL 64 N 0.71 4.95 -0.26 3.82 1.01 0.13 -4.92 120.40 125.84 1req s VAL 64 Ca 0.43 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.41 1req s VAL 64 Cb -0.20 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 33.04 1req s VAL 64 CO 0.23 0.54 -0.05 -1.00 0.00 0.00 0.00 175.10 174.81 1req s HIS 65 N -0.34 3.13 1.10 5.22 3.76 -1.26 0.19 115.29 127.09 1req s HIS 65 Ca 0.09 -1.72 -0.15 0.00 -0.15 0.00 0.00 55.06 53.13 1req s HIS 65 Cb -0.12 -2.05 0.24 0.00 1.11 0.00 0.00 32.58 31.75 1req s HIS 65 CO 0.02 -0.77 1.09 0.95 -0.85 0.00 0.00 174.74 175.17 1req s THR 66 N 1.28 1.86 0.24 1.30 -4.23 -0.39 -4.88 115.64 110.81 1req s THR 66 Ca -0.02 0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.44 1req s THR 66 Cb -0.18 -2.44 0.22 0.00 1.34 0.00 0.00 72.50 71.44 1req s THR 66 CO -0.04 0.00 1.71 0.58 -0.54 0.00 0.00 174.62 176.34 1req h VAL 67 N -2.24 0.61 -0.38 2.29 2.07 -1.97 -2.22 116.25 114.41 1req h VAL 67 Ca -0.52 -0.13 -0.15 0.00 0.82 0.00 0.00 66.70 66.72 1req h VAL 67 Cb 1.32 0.20 -0.09 0.00 -1.52 0.00 0.00 31.29 31.21 1req h VAL 67 CO 0.49 0.07 0.19 -0.90 0.02 0.00 0.00 177.57 177.44 1req n ASP 68 N -5.06 3.26 -1.21 0.57 5.68 -1.26 -4.91 116.55 113.63 1req n ASP 68 Ca 0.14 -2.61 -0.11 0.00 -0.50 0.00 0.00 54.79 51.71 1req n ASP 68 Cb 0.43 -0.63 -0.01 0.00 -1.14 0.00 0.00 41.12 39.77 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 -0.04 0.14 3.70 6.12 0.00 -0.84 -4.97 105.19 109.29 1req n GLY 69 Ca 0.22 -0.43 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.54 4.99 -0.27 -0.61 -1.09 -1.26 -4.84 121.20 115.58 1req s ILE 70 Ca 0.00 1.49 -0.20 0.00 -2.23 0.00 0.00 60.65 59.71 1req s ILE 70 Cb 0.00 -4.07 -0.02 0.00 -1.58 0.00 0.00 42.46 36.79 1req s ILE 70 CO 0.00 0.17 0.61 -1.81 -1.23 0.00 0.00 174.94 172.68 1req s ASP 71 N 0.95 6.52 -0.23 3.58 1.11 -1.26 -1.27 116.67 126.08 1req s ASP 71 Ca 0.37 0.57 -0.03 0.00 0.18 0.00 0.00 52.55 53.65 1req s ASP 71 Cb -0.17 -2.33 0.00 0.00 1.07 0.00 0.00 42.92 41.50 1req s ASP 71 CO 0.16 -0.40 -0.06 -0.63 1.18 0.00 0.00 175.17 175.43 1req s ILE 72 N 2.51 3.15 0.52 0.77 1.01 0.13 -4.98 121.20 124.31 1req s ILE 72 Ca 0.25 -0.69 -0.02 0.00 0.00 0.00 0.00 60.65 60.19 1req s ILE 72 Cb -0.15 -2.48 0.00 0.00 0.01 0.00 0.00 42.46 39.84 1req s ILE 72 CO 0.10 0.35 0.77 0.68 0.00 0.00 0.00 174.94 176.84 1req s VAL 73 N 1.42 3.75 -0.08 2.92 -7.23 -1.26 -0.69 120.40 119.22 1req s VAL 73 Ca 0.04 -0.31 0.17 0.00 -1.81 0.00 0.00 61.98 60.07 1req s VAL 73 Cb -0.15 -3.43 0.10 0.00 0.56 0.00 0.00 36.38 33.46 1req s VAL 73 CO -0.04 -0.36 1.53 1.55 -0.31 0.00 0.00 175.10 177.47 1req h PRO 74 N 0.14 0.00 -3.80 4.82 0.13 -1.92 -3.45 132.00 127.91 1req h PRO 74 Ca -0.45 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.40 1req h PRO 74 Cb 1.26 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.09 1req h PRO 74 CO 0.58 0.45 -0.73 1.41 -0.23 0.00 0.00 178.00 179.48 1req s MET 75 N -3.13 0.12 0.17 0.86 1.75 -1.26 -5.16 119.30 112.65 1req s MET 75 Ca 0.03 0.01 0.08 0.00 -1.25 0.00 0.00 55.69 54.56 1req s MET 75 Cb 0.08 -0.19 -0.04 0.00 2.84 0.00 0.00 34.83 37.52 1req s MET 75 CO 0.72 -0.03 -0.07 0.71 -0.65 0.00 0.00 175.02 175.71 1req s TYR 76 N 0.30 2.72 0.23 4.11 1.51 -1.26 -5.05 117.35 119.90 1req s TYR 76 Ca -0.03 -0.18 0.04 0.00 -1.01 0.00 0.00 57.07 55.89 1req s TYR 76 Cb -0.05 -1.34 -0.05 0.00 -0.11 0.00 0.00 41.96 40.42 1req s TYR 76 CO -0.01 0.50 -0.01 1.03 -1.11 0.00 0.00 175.55 175.96 1req s ARG 77 N -2.78 1.34 0.41 -0.62 0.52 -1.26 -4.86 118.95 111.70 1req s ARG 77 Ca 0.25 -1.67 0.15 0.00 -0.52 0.00 0.00 55.73 53.94 1req s ARG 77 Cb -0.09 -0.64 1.01 0.00 0.52 0.00 0.00 34.95 35.75 1req s ARG 77 CO 0.16 -0.09 1.89 -1.35 0.02 0.00 0.00 175.30 175.94 1req h PRO 78 N 2.47 0.46 0.00 3.54 0.11 -1.98 -1.64 132.00 134.96 1req h PRO 78 Ca -0.38 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1req h PRO 78 Cb 1.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1req h PRO 78 CO 0.65 0.30 0.00 0.36 -0.21 0.00 0.00 178.00 179.10 1req n LYS 79 N -4.50 0.16 0.02 1.05 2.85 -1.26 -1.83 118.16 114.64 1req n LYS 79 Ca 0.16 0.60 0.14 0.00 -1.05 0.00 0.00 58.31 58.15 1req n LYS 79 Cb 0.56 -1.96 0.53 0.00 -0.65 0.00 0.00 35.03 33.51 1req n LYS 79 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1req n ASP 80 N -2.28 0.20 -4.68 -5.58 8.00 -0.62 -4.82 116.55 106.78 1req n ASP 80 Ca -0.01 0.39 -0.29 0.00 0.71 0.00 0.00 54.79 55.59 1req n ASP 80 Cb 0.08 -0.41 -0.08 0.00 -0.02 0.00 0.00 41.12 40.69 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 -3.02 3.25 0.70 2.24 0.00 -0.76 -3.37 121.76 120.79 1req s ALA 81 Ca 0.13 -1.18 -0.15 0.00 0.00 0.00 0.00 51.96 50.76 1req s ALA 81 Cb 0.18 -1.13 0.02 0.00 0.00 0.00 0.00 23.12 22.19 1req s ALA 81 CO 0.57 0.64 1.14 -1.25 0.00 0.00 0.00 175.76 176.86 1req s PRO 82 N -2.46 2.51 0.09 0.00 0.04 -1.26 -4.98 135.00 128.94 1req s PRO 82 Ca 0.26 1.49 -0.17 0.00 0.04 0.00 0.00 61.00 62.62 1req s PRO 82 Cb -0.11 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.44 1req s PRO 82 CO 0.18 -1.49 1.47 0.87 0.04 0.00 0.00 177.00 178.07 1req h LYS 83 N -0.20 0.53 -5.32 4.56 6.56 -1.97 -3.37 116.57 117.36 1req h LYS 83 Ca -0.47 -0.21 -0.63 0.00 -1.06 0.00 0.00 60.65 58.28 1req h LYS 83 Cb 1.26 -0.03 -0.14 0.00 -0.57 0.00 0.00 32.23 32.76 1req h LYS 83 CO 0.52 0.75 -0.02 0.15 -2.06 0.00 0.00 179.45 178.79 1req s LYS 84 N -4.71 3.87 0.32 3.15 1.02 -1.26 -4.94 119.74 117.18 1req s LYS 84 Ca -0.13 0.12 0.15 0.00 0.02 0.00 0.00 55.97 56.12 1req s LYS 84 Cb 0.08 -3.72 0.49 0.00 -0.52 0.00 0.00 37.83 34.15 1req s LYS 84 CO 0.77 -0.49 1.66 -0.07 -0.92 0.00 0.00 175.35 176.30 1req h LEU 85 N 8.95 0.00 -0.01 3.17 3.38 -2.01 -3.49 115.31 125.30 1req h LEU 85 Ca -0.28 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.69 1req h LEU 85 Cb 1.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 1req h LEU 85 CO 0.74 0.51 -0.01 0.61 0.09 0.00 0.00 178.44 180.37 1req n GLY 86 N 0.31 -1.81 2.99 0.83 0.00 -1.26 -4.86 105.19 101.39 1req n GLY 86 Ca -0.01 -1.50 -0.16 0.00 0.00 0.00 0.00 46.02 44.35 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 -1.81 0.60 0.37 1.61 1.51 -1.26 -5.03 117.35 113.34 1req s TYR 87 Ca 0.00 -0.16 -0.26 0.00 -1.01 0.00 0.00 57.07 55.64 1req s TYR 87 Cb 0.00 -0.38 -0.09 0.00 -0.11 0.00 0.00 41.96 41.38 1req s TYR 87 CO 0.00 -0.02 1.10 -1.25 -1.11 0.00 0.00 175.55 174.28 1req s PRO 88 N -0.34 4.24 0.00 -1.71 0.04 -1.26 -3.49 135.00 132.48 1req s PRO 88 Ca 0.01 1.69 0.00 0.00 0.04 0.00 0.00 61.00 62.74 1req s PRO 88 Cb -0.03 -2.75 0.00 0.00 0.04 0.00 0.00 34.50 31.76 1req s PRO 88 CO -0.00 -0.11 0.00 0.41 0.04 0.00 0.00 177.00 177.34 1req n GLY 89 N 0.65 0.53 2.90 0.56 0.00 0.10 -4.89 105.19 105.04 1req n GLY 89 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.18 -0.03 0.32 1.61 1.01 -1.23 -4.93 120.40 114.97 1req s VAL 90 Ca 0.00 0.11 -0.26 0.00 0.00 0.00 0.00 61.98 61.83 1req s VAL 90 Cb 0.00 -0.14 -0.14 0.00 0.00 0.00 0.00 36.38 36.10 1req s VAL 90 CO 0.00 0.04 0.75 0.00 0.00 0.00 0.00 175.10 175.90 1req n ALA 91 N 3.66 -1.19 1.83 5.51 0.00 -1.26 -1.72 120.51 127.35 1req n ALA 91 Ca -0.20 0.32 0.08 0.00 0.00 0.00 0.00 53.44 53.63 1req n ALA 91 Cb 0.55 -1.85 0.45 0.00 0.00 0.00 0.00 19.45 18.59 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 0.71 0.92 -0.94 0.00 -0.04 -1.26 -4.83 135.00 129.56 1req n PRO 92 Ca 0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 1req n PRO 92 Cb 0.33 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 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 -0.76 0.00 -0.11 0.54 3.01 -0.70 -4.15 117.46 115.29 1req n PHE 93 Ca 0.11 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.52 1req n PHE 93 Cb 0.05 -1.64 0.01 0.00 -0.01 0.00 0.00 39.48 37.89 1req n PHE 93 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1req h THR 94 N 0.00 0.59 0.00 4.37 2.02 -1.83 -1.96 112.91 116.10 1req h THR 94 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1req h THR 94 Cb 0.73 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 1req h THR 94 CO 0.00 0.00 0.00 0.03 0.37 0.00 0.00 175.52 175.92 1req h ARG 95 N -0.02 0.00 0.00 6.66 3.08 -1.89 -3.42 114.38 118.79 1req h ARG 95 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1req h ARG 95 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1req h ARG 95 CO -0.40 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 178.91 1req n GLY 96 N -0.37 3.79 0.10 0.04 0.00 -0.74 -4.26 105.19 103.76 1req n GLY 96 Ca -0.01 -0.91 -0.18 0.00 0.00 0.00 0.00 46.02 44.93 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 -1.33 1.50 -3.68 2.61 -1.04 -1.26 0.01 114.28 111.10 1req n THR 97 Ca 0.00 -0.04 -0.36 0.00 -2.04 0.00 0.00 64.05 61.61 1req n THR 97 Cb 0.00 -2.13 -0.09 0.00 -1.82 0.00 0.00 70.33 66.29 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 -2.47 5.37 0.11 12.58 2.01 -1.26 -3.54 115.64 128.44 1req s THR 98 Ca -0.28 0.20 -0.30 0.00 0.31 0.00 0.00 61.69 61.62 1req s THR 98 Cb 0.07 -3.50 -0.06 0.00 0.01 0.00 0.00 72.50 69.02 1req s THR 98 CO 0.45 0.38 1.09 -0.69 -0.69 0.00 0.00 174.62 175.16 1req s VAL 99 N 0.81 4.17 0.15 3.82 1.01 -1.26 -4.89 120.40 124.20 1req s VAL 99 Ca 0.08 1.71 -0.14 0.00 0.00 0.00 0.00 61.98 63.63 1req s VAL 99 Cb -0.13 -4.09 -0.07 0.00 0.00 0.00 0.00 36.38 32.09 1req s VAL 99 CO 0.02 0.22 0.55 -0.13 0.00 0.00 0.00 175.10 175.76 1req s ARG 100 N 0.32 3.96 0.00 2.72 0.52 -1.26 -5.00 118.95 120.20 1req s ARG 100 Ca 0.52 0.47 0.24 0.00 -0.52 0.00 0.00 55.73 56.44 1req s ARG 100 Cb -0.27 -2.91 0.37 0.00 0.52 0.00 0.00 34.95 32.66 1req s ARG 100 CO 0.31 0.47 1.36 0.27 0.02 0.00 0.00 175.30 177.74 1req n ASN 101 N 0.73 3.08 0.00 0.23 0.23 -1.26 -4.81 115.26 113.46 1req n ASN 101 Ca -0.05 -1.96 0.00 0.00 -0.53 0.00 0.00 54.58 52.04 1req n ASN 101 Cb 0.52 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 38.10 1req n ASN 101 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1req n GLY 102 N 1.41 0.59 3.83 4.83 0.00 -1.26 -5.08 105.19 109.50 1req n GLY 102 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.96 6.19 0.20 1.61 1.01 -1.26 -4.79 116.67 116.67 1req s ASP 103 Ca 0.00 1.66 -0.04 0.00 0.71 0.00 0.00 52.55 54.87 1req s ASP 103 Cb 0.00 -2.51 0.14 0.00 1.01 0.00 0.00 42.92 41.56 1req s ASP 103 CO 0.00 -0.89 1.56 0.00 0.21 0.00 0.00 175.17 176.06 1req h MET 104 N 0.53 0.69 -4.88 8.23 -0.00 -1.91 -3.32 114.93 114.28 1req h MET 104 Ca -0.46 -0.35 -0.73 0.00 -0.00 0.00 0.00 59.70 58.16 1req h MET 104 Cb 1.20 0.00 -0.17 0.00 -0.00 0.00 0.00 31.60 32.64 1req h MET 104 CO 0.60 0.96 1.44 -0.51 -0.00 0.00 0.00 176.91 179.39 1req s ASP 105 N -6.84 7.04 0.07 -0.10 1.01 -1.26 -4.61 116.67 111.98 1req s ASP 105 Ca -0.09 -2.92 -0.10 0.00 0.71 0.00 0.00 52.55 50.15 1req s ASP 105 Cb 0.12 -2.42 -0.27 0.00 1.01 0.00 0.00 42.92 41.36 1req s ASP 105 CO 0.84 -0.80 1.12 0.00 0.21 0.00 0.00 175.17 176.55 1req h ALA 106 N 7.22 0.05 -0.57 5.23 0.00 -1.82 -3.46 119.26 125.90 1req h ALA 106 Ca 0.33 -0.81 -0.62 0.00 0.00 0.00 0.00 54.91 53.81 1req h ALA 106 Cb 0.87 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.66 1req h ALA 106 CO 1.27 0.79 -0.40 1.67 0.00 0.00 0.00 179.25 182.58 1req s TRP 107 N -2.85 1.80 -0.24 0.00 -2.14 -1.26 -4.98 118.94 109.27 1req s TRP 107 Ca -0.07 -0.86 -0.11 0.00 2.66 0.00 0.00 56.10 57.72 1req s TRP 107 Cb 0.06 -1.80 -0.05 0.00 -3.10 0.00 0.00 33.47 28.58 1req s TRP 107 CO 0.91 -0.15 0.18 0.34 -2.66 0.00 0.00 176.95 175.57 1req s ASP 108 N -4.10 6.14 -0.46 -2.66 2.15 -0.88 -5.01 116.67 111.86 1req s ASP 108 Ca 0.24 0.14 -0.28 0.00 0.43 0.00 0.00 52.55 53.07 1req s ASP 108 Cb -0.00 -2.12 0.03 0.00 -0.30 0.00 0.00 42.92 40.53 1req s ASP 108 CO 0.14 0.05 1.10 -0.69 -0.17 0.00 0.00 175.17 175.60 1req s VAL 109 N 1.13 4.27 -0.31 1.11 1.01 -1.26 -1.98 120.40 124.37 1req s VAL 109 Ca 0.08 1.21 -0.06 0.00 0.00 0.00 0.00 61.98 63.21 1req s VAL 109 Cb -0.14 -4.56 0.02 0.00 0.00 0.00 0.00 36.38 31.70 1req s VAL 109 CO 0.05 -0.94 0.08 -0.60 0.00 0.00 0.00 175.10 173.69 1req s ARG 110 N 4.29 2.87 0.09 2.72 3.52 -1.02 -0.14 118.95 131.28 1req s ARG 110 Ca 0.46 -1.00 -0.21 0.00 -0.13 0.00 0.00 55.73 54.85 1req s ARG 110 Cb -0.08 -3.37 -0.07 0.00 -1.56 0.00 0.00 34.95 29.87 1req s ARG 110 CO 0.29 -0.53 0.63 0.00 -0.81 0.00 0.00 175.30 174.88 1req s ALA 111 N 1.44 3.54 -0.22 6.12 0.00 -0.86 -4.02 121.76 127.75 1req s ALA 111 Ca 0.01 0.12 -0.21 0.00 0.00 0.00 0.00 51.96 51.88 1req s ALA 111 Cb -0.18 -2.73 -0.02 0.00 0.00 0.00 0.00 23.12 20.19 1req s ALA 111 CO 0.02 0.35 0.65 -1.17 0.00 0.00 0.00 175.76 175.61 1req s LEU 112 N -1.02 4.11 -0.16 0.00 2.96 -1.26 -1.44 118.68 121.87 1req s LEU 112 Ca 0.31 0.82 0.00 0.00 -0.22 0.00 0.00 54.13 55.04 1req s LEU 112 Cb -0.20 -2.91 0.02 0.00 0.50 0.00 0.00 46.19 43.60 1req s LEU 112 CO 0.21 -0.34 -0.14 -1.00 -1.32 0.00 0.00 176.35 173.77 1req s HIS 113 N 2.22 2.21 0.00 5.38 3.76 0.58 -4.98 115.29 124.46 1req s HIS 113 Ca 0.29 -1.28 0.00 0.00 -0.15 0.00 0.00 55.06 53.92 1req s HIS 113 Cb -0.16 -1.61 0.00 0.00 1.11 0.00 0.00 32.58 31.93 1req s HIS 113 CO 0.09 -0.68 0.27 0.39 -0.85 0.00 0.00 174.74 173.97 1req n GLU 114 N 4.76 -0.17 -2.53 1.40 1.02 -1.26 -1.67 120.64 122.19 1req n GLU 114 Ca -0.17 -0.30 -0.42 0.00 -0.02 0.00 0.00 57.16 56.25 1req n GLU 114 Cb 0.50 -0.70 -0.03 0.00 -0.02 0.00 0.00 31.44 31.19 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 -0.06 7.13 0.26 1.62 -1.08 -1.26 -4.06 116.67 119.23 1req s ASP 115 Ca 0.00 1.75 -0.02 0.00 -0.52 0.00 0.00 52.55 53.76 1req s ASP 115 Cb 0.00 -2.56 0.34 0.00 -1.46 0.00 0.00 42.92 39.24 1req s ASP 115 CO 0.00 -0.51 1.79 1.55 0.52 0.00 0.00 175.17 178.53 1req h PRO 116 N 7.23 0.87 -6.12 4.34 0.13 -1.88 -3.41 132.00 133.16 1req h PRO 116 Ca -0.35 -0.19 -0.67 0.00 -0.87 0.00 0.00 66.00 63.92 1req h PRO 116 Cb 1.17 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1req h PRO 116 CO 0.85 0.80 1.19 -3.47 -0.23 0.00 0.00 178.00 177.15 1req n ASP 117 N -4.25 2.69 0.23 1.44 -0.08 -1.26 -4.76 116.55 110.55 1req n ASP 117 Ca 0.04 0.75 0.12 0.00 -1.51 0.00 0.00 54.79 54.18 1req n ASP 117 Cb 0.25 -1.28 0.42 0.00 2.34 0.00 0.00 41.12 42.85 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 10.23 0.00 0.11 -0.67 -0.00 -1.98 -2.33 114.58 119.94 1req h GLU 118 Ca -0.40 0.00 -0.28 0.00 -0.00 0.00 0.00 59.36 58.68 1req h GLU 118 Cb 1.30 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 30.05 1req h GLU 118 CO 0.98 0.15 -1.34 0.87 -0.00 0.00 0.00 179.01 179.67 1req h LYS 119 N 0.00 0.24 1.00 1.06 1.79 -1.95 -3.09 116.57 115.62 1req h LYS 119 Ca -0.00 -0.41 -0.05 0.00 -2.18 0.00 0.00 60.65 58.01 1req h LYS 119 Cb 0.80 0.15 0.01 0.00 -1.58 0.00 0.00 32.23 31.61 1req h LYS 119 CO 0.02 1.15 -0.48 0.35 -1.08 0.00 0.00 179.45 179.41 1req h PHE 120 N 0.07 -1.24 -0.82 -1.35 3.57 -1.89 -3.05 116.94 112.22 1req h PHE 120 Ca -0.17 -0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.35 1req h PHE 120 Cb 1.98 0.41 -0.06 0.00 2.79 0.00 0.00 35.95 41.07 1req h PHE 120 CO 0.06 -0.77 0.51 1.15 -2.23 0.00 0.00 178.31 177.03 1req h THR 121 N -1.36 1.07 -0.03 4.41 2.02 -1.54 0.73 112.91 118.21 1req h THR 121 Ca -0.14 -0.33 0.01 0.00 0.77 0.00 0.00 66.41 66.73 1req h THR 121 Cb 1.03 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 1req h THR 121 CO 0.22 0.18 -0.04 -0.09 0.37 0.00 0.00 175.52 176.16 1req h ARG 122 N 0.96 -0.06 -0.15 6.66 2.43 -1.62 0.36 114.38 122.96 1req h ARG 122 Ca 0.35 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.54 1req h ARG 122 Cb 0.11 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1req h ARG 122 CO -0.15 -0.04 0.03 0.87 -1.51 0.00 0.00 179.97 179.17 1req h LYS 123 N -0.06 0.09 -0.03 0.20 1.57 -1.39 -2.38 116.57 114.56 1req h LYS 123 Ca 0.03 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1req h LYS 123 Cb 0.10 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1req h LYS 123 CO -0.07 0.06 0.02 0.00 -0.57 0.00 0.00 179.45 178.89 1req h ALA 124 N 1.11 0.04 -0.01 3.86 0.00 -0.63 -0.03 119.26 123.60 1req h ALA 124 Ca 0.07 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1req h ALA 124 Cb 0.06 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1req h ALA 124 CO -0.09 -0.45 -0.42 0.82 0.00 0.00 0.00 179.25 179.12 1req h ILE 125 N 0.02 0.16 -0.40 0.00 2.04 -0.37 -1.68 117.51 117.28 1req h ILE 125 Ca 0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.89 1req h ILE 125 Cb 0.02 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.23 1req h ILE 125 CO -0.00 0.00 0.24 0.25 0.00 0.00 0.00 178.15 178.64 1req h LEU 126 N -0.57 0.40 -0.80 1.44 5.85 -1.18 -1.87 115.31 118.58 1req h LEU 126 Ca 0.05 -0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.81 1req h LEU 126 Cb 0.65 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 1req h LEU 126 CO -0.32 0.29 0.50 -0.08 -0.34 0.00 0.00 178.44 178.49 1req h GLU 127 N 0.49 0.92 0.15 1.25 4.81 -0.81 -0.45 114.58 120.94 1req h GLU 127 Ca 0.16 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1req h GLU 127 Cb -0.01 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.16 1req h GLU 127 CO -0.06 0.61 -0.07 0.78 -0.73 0.00 0.00 179.01 179.53 1req h GLY 128 N 0.94 -0.21 2.00 1.92 0.00 -1.26 -2.85 103.07 103.61 1req h GLY 128 Ca 0.34 0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.73 1req h GLY 128 CO -0.14 -0.08 -0.10 1.41 0.00 0.00 0.00 176.54 177.63 1req h LEU 129 N -0.21 0.00 0.00 3.11 3.38 -0.45 0.74 115.31 121.88 1req h LEU 129 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1req h LEU 129 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1req h LEU 129 CO 0.03 0.10 0.00 -0.62 0.09 0.00 0.00 178.44 178.05 1req n GLU 130 N -4.02 0.11 -2.25 1.13 1.02 -0.27 -4.01 120.64 112.36 1req n GLU 130 Ca -0.02 0.03 -0.20 0.00 -0.02 0.00 0.00 57.16 56.95 1req n GLU 130 Cb 0.19 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.13 1req n GLU 130 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1req n ARG 131 N -1.44 3.18 -0.71 3.49 1.74 0.11 -4.96 116.66 118.07 1req n ARG 131 Ca 0.08 -4.08 0.00 0.00 -0.77 0.00 0.00 57.85 53.09 1req n ARG 131 Cb 0.29 -2.12 0.00 0.00 -1.02 0.00 0.00 32.46 29.60 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 -0.63 0.65 3.75 -0.13 0.00 -1.12 -4.94 105.19 102.78 1req n GLY 132 Ca 0.36 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.05 3.80 -0.27 1.61 1.01 -0.33 -4.75 120.40 119.41 1req s VAL 133 Ca 0.00 1.82 0.11 0.00 0.00 0.00 0.00 61.98 63.91 1req s VAL 133 Cb 0.00 -4.15 -0.15 0.00 0.00 0.00 0.00 36.38 32.08 1req s VAL 133 CO 0.00 0.43 0.36 0.35 0.00 0.00 0.00 175.10 176.24 1req n THR 134 N 1.34 0.00 -3.47 3.92 -2.24 0.81 -4.55 114.28 110.09 1req n THR 134 Ca -0.02 -0.25 -0.13 0.00 -2.27 0.00 0.00 64.05 61.39 1req n THR 134 Cb 0.46 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 69.30 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 -2.63 -0.54 0.03 3.42 1.04 -1.02 -4.26 113.70 109.73 1req s SER 135 Ca 0.00 0.08 0.06 0.00 0.48 0.00 0.00 55.95 56.57 1req s SER 135 Cb 0.08 0.57 -0.03 0.00 0.10 0.00 0.00 66.02 66.74 1req s SER 135 CO 0.46 -0.89 -0.15 -0.76 0.98 0.00 0.00 173.24 172.87 1req s LEU 136 N -2.49 2.76 -0.31 2.42 1.43 -0.79 -2.04 118.68 119.66 1req s LEU 136 Ca -0.01 -0.35 -0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1req s LEU 136 Cb -0.01 -1.60 0.10 0.00 0.03 0.00 0.00 46.19 44.71 1req s LEU 136 CO -0.09 0.26 0.09 -0.22 0.23 0.00 0.00 176.35 176.62 1req s LEU 137 N -1.45 2.59 -0.17 1.79 2.96 -0.52 -0.06 118.68 123.81 1req s LEU 137 Ca 0.15 -1.71 -0.06 0.00 -0.22 0.00 0.00 54.13 52.29 1req s LEU 137 Cb -0.11 -0.97 -0.04 0.00 0.50 0.00 0.00 46.19 45.58 1req s LEU 137 CO 0.06 -0.41 0.03 -0.76 -1.32 0.00 0.00 176.35 173.95 1req s LEU 138 N 1.52 3.63 -0.49 -0.68 1.02 -0.92 -0.31 118.68 122.46 1req s LEU 138 Ca 0.10 0.01 -0.25 0.00 0.02 0.00 0.00 54.13 54.01 1req s LEU 138 Cb -0.17 -1.91 0.03 0.00 0.02 0.00 0.00 46.19 44.16 1req s LEU 138 CO -0.23 0.17 0.94 -0.60 0.02 0.00 0.00 176.35 176.65 1req s ARG 139 N 0.37 3.48 -0.39 1.70 3.52 -0.67 -1.87 118.95 125.09 1req s ARG 139 Ca 0.01 0.06 -0.09 0.00 -0.13 0.00 0.00 55.73 55.58 1req s ARG 139 Cb -0.13 -3.96 0.06 0.00 -1.56 0.00 0.00 34.95 29.36 1req s ARG 139 CO 0.01 -1.30 0.21 0.08 -0.81 0.00 0.00 175.30 173.50 1req s VAL 140 N 3.83 4.21 0.33 7.11 1.01 0.14 -1.93 120.40 135.11 1req s VAL 140 Ca 0.36 -1.22 -0.15 0.00 0.00 0.00 0.00 61.98 60.97 1req s VAL 140 Cb -0.11 -3.49 0.03 0.00 0.00 0.00 0.00 36.38 32.82 1req s VAL 140 CO 0.25 -0.38 0.67 -1.81 0.00 0.00 0.00 175.10 173.84 1req s ASP 141 N 1.82 0.05 0.31 3.32 1.01 -0.62 -4.40 116.67 118.17 1req s ASP 141 Ca 0.02 -1.02 -0.01 0.00 0.71 0.00 0.00 52.55 52.25 1req s ASP 141 Cb -0.21 0.75 0.49 0.00 1.01 0.00 0.00 42.92 44.95 1req s ASP 141 CO 0.03 -1.45 1.97 1.55 0.21 0.00 0.00 175.17 177.48 1req h PRO 142 N 2.06 1.03 -0.67 8.23 0.13 -1.96 -2.05 132.00 138.77 1req h PRO 142 Ca -0.27 -0.06 -0.03 0.00 -0.87 0.00 0.00 66.00 64.77 1req h PRO 142 Cb 1.25 -0.23 -0.02 0.00 0.13 0.00 0.00 31.00 32.13 1req h PRO 142 CO 0.35 0.68 0.04 -0.40 -0.23 0.00 0.00 178.00 178.44 1req n ASP 143 N -4.42 4.90 0.00 1.44 5.75 -1.26 -4.95 116.55 118.01 1req n ASP 143 Ca 0.09 -2.82 0.00 0.00 -0.01 0.00 0.00 54.79 52.05 1req n ASP 143 Cb 0.05 -0.67 0.00 0.00 -1.03 0.00 0.00 41.12 39.47 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 0.43 0.00 -2.53 2.12 0.00 -0.77 -4.49 120.51 115.26 1req n ALA 144 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.27 1req n ALA 144 Cb 1.08 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.50 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 1.87 4.39 0.37 0.00 1.01 -0.81 -3.89 121.20 124.14 1req s ILE 145 Ca 0.00 1.71 -0.26 0.00 0.00 0.00 0.00 60.65 62.10 1req s ILE 145 Cb 0.00 -4.10 -0.09 0.00 0.01 0.00 0.00 42.46 38.28 1req s ILE 145 CO 0.00 0.08 1.14 0.00 0.00 0.00 0.00 174.94 176.16 1req s ALA 146 N 1.47 3.22 0.42 9.38 0.00 -1.26 -1.60 121.76 133.39 1req s ALA 146 Ca 0.55 0.92 0.18 0.00 0.00 0.00 0.00 51.96 53.61 1req s ALA 146 Cb -0.25 -3.35 1.10 0.00 0.00 0.00 0.00 23.12 20.62 1req s ALA 146 CO 0.26 -0.39 1.86 -1.35 0.00 0.00 0.00 175.76 176.13 1req h PRO 147 N 2.92 0.38 0.00 0.00 0.11 -1.92 0.31 132.00 133.80 1req h PRO 147 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1req h PRO 147 Cb 1.22 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1req h PRO 147 CO 0.64 0.25 0.00 1.05 -0.21 0.00 0.00 178.00 179.73 1req h GLU 148 N 0.39 0.00 -0.01 1.05 4.11 -1.94 -3.20 114.58 114.98 1req h GLU 148 Ca 0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.90 1req h GLU 148 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1req h GLU 148 CO -0.17 0.00 -0.63 0.72 0.07 0.00 0.00 179.01 178.99 1req n HIS 149 N -3.01 0.00 -0.18 2.06 8.25 0.11 -4.48 115.22 117.97 1req n HIS 149 Ca -0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.42 1req n HIS 149 Cb 0.23 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.41 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 1.37 0.37 -0.77 2.41 5.85 -1.52 -1.58 115.31 121.44 1req h LEU 150 Ca 0.00 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.81 1req h LEU 150 Cb 0.61 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.55 1req h LEU 150 CO 0.00 0.25 0.47 -0.78 -0.34 0.00 0.00 178.44 178.04 1req h ASP 151 N 0.51 0.74 1.13 1.25 1.82 -1.82 -2.65 116.42 117.40 1req h ASP 151 Ca 0.25 0.01 -0.08 0.00 -0.39 0.00 0.00 57.03 56.82 1req h ASP 151 Cb 0.18 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.04 1req h ASP 151 CO -0.18 0.49 -0.38 -0.08 -1.61 0.00 0.00 179.24 177.47 1req h GLU 152 N 0.88 0.00 0.00 0.28 4.81 -1.60 -2.94 114.58 116.00 1req h GLU 152 Ca 0.33 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 1req h GLU 152 Cb 0.13 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1req h GLU 152 CO -0.16 0.38 -0.47 -0.39 -0.73 0.00 0.00 179.01 177.64 1req h VAL 153 N 0.00 0.00 -0.24 0.32 -1.51 -1.22 -2.89 116.25 110.70 1req h VAL 153 Ca -0.00 -0.93 0.00 0.00 -1.23 0.00 0.00 66.70 64.54 1req h VAL 153 Cb 1.05 1.69 0.00 0.00 -2.13 0.00 0.00 31.29 31.89 1req h VAL 153 CO 0.05 0.00 0.00 0.18 -1.23 0.00 0.00 177.57 176.57 1req n LEU 154 N -2.80 2.01 -0.30 4.19 4.77 -1.02 -4.42 117.00 119.44 1req n LEU 154 Ca 0.02 -0.88 0.09 0.00 -0.03 0.00 0.00 56.01 55.21 1req n LEU 154 Cb 0.53 -0.16 0.31 0.00 -2.33 0.00 0.00 43.42 41.77 1req n LEU 154 CO 0.36 0.44 1.23 -1.28 -1.33 0.00 0.00 177.39 176.81 1req h SER 155 N 2.55 0.79 0.01 -1.43 0.87 -1.32 0.29 113.55 115.31 1req h SER 155 Ca 0.00 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1req h SER 155 Cb 0.56 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.40 1req h SER 155 CO 0.00 0.43 -0.09 0.47 -0.53 0.00 0.00 176.83 177.11 1req n ASP 156 N -4.56 2.05 -4.65 6.23 8.00 -1.26 -4.92 116.55 117.43 1req n ASP 156 Ca 0.17 -1.61 -0.43 0.00 0.71 0.00 0.00 54.79 53.63 1req n ASP 156 Cb 0.37 0.07 -0.02 0.00 -0.02 0.00 0.00 41.12 41.52 1req n ASP 156 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1req s VAL 157 N -2.12 4.53 -0.64 2.53 1.01 0.10 -4.96 120.40 120.84 1req s VAL 157 Ca 0.30 1.82 -0.27 0.00 0.00 0.00 0.00 61.98 63.83 1req s VAL 157 Cb 0.20 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 32.34 1req s VAL 157 CO 0.37 -0.25 1.41 -0.76 0.00 0.00 0.00 175.10 175.88 1req s LEU 158 N 3.43 3.29 0.61 3.92 1.43 -1.26 -4.90 118.68 125.20 1req s LEU 158 Ca 0.47 -0.02 0.33 0.00 -1.03 0.00 0.00 54.13 53.89 1req s LEU 158 Cb -0.16 -2.78 1.93 0.00 0.03 0.00 0.00 46.19 45.21 1req s LEU 158 CO 0.11 -1.85 2.25 -0.07 0.23 0.00 0.00 176.35 177.01 1req h LEU 159 N 13.51 0.00 -0.37 1.79 3.38 -1.93 -0.66 115.31 131.01 1req h LEU 159 Ca -0.27 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.53 1req h LEU 159 Cb 1.08 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 1req h LEU 159 CO 1.23 0.00 -0.81 1.05 0.09 0.00 0.00 178.44 179.99 1req h GLU 160 N 0.00 0.01 0.00 1.13 9.09 -1.90 -3.36 114.58 119.55 1req h GLU 160 Ca 0.01 -0.01 -0.36 0.00 0.05 0.00 0.00 59.36 59.06 1req h GLU 160 Cb 0.11 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 27.15 1req h GLU 160 CO -0.00 0.82 -2.25 -0.12 0.05 0.00 0.00 179.01 177.51 1req n MET 161 N -3.58 0.68 -4.78 1.06 0.00 -0.40 -4.88 117.12 105.22 1req n MET 161 Ca -0.01 0.08 -0.33 0.00 0.00 0.00 0.00 57.70 57.45 1req n MET 161 Cb 0.78 -1.58 -0.16 0.00 0.00 0.00 0.00 33.22 32.26 1req n MET 161 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 1req s THR 162 N -2.52 2.43 0.08 1.12 2.01 -0.39 -5.03 115.64 113.33 1req s THR 162 Ca -0.12 -0.87 -0.30 0.00 0.31 0.00 0.00 61.69 60.71 1req s THR 162 Cb 0.07 -1.99 -0.05 0.00 0.01 0.00 0.00 72.50 70.53 1req s THR 162 CO 0.80 0.54 1.11 -0.75 -0.69 0.00 0.00 174.62 175.63 1req s LYS 163 N 0.62 4.51 -0.11 4.92 2.20 -1.26 -4.65 119.74 125.97 1req s LYS 163 Ca -0.10 1.66 -0.01 0.00 -0.36 0.00 0.00 55.97 57.16 1req s LYS 163 Cb -0.16 -3.36 -0.03 0.00 -1.51 0.00 0.00 37.83 32.77 1req s LYS 163 CO 0.03 -0.11 -0.07 0.08 -0.36 0.00 0.00 175.35 174.92 1req s VAL 164 N 0.70 3.62 0.12 4.02 1.01 -1.25 -1.88 120.40 126.75 1req s VAL 164 Ca 0.54 -0.48 0.10 0.00 0.00 0.00 0.00 61.98 62.14 1req s VAL 164 Cb -0.27 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1req s VAL 164 CO 0.30 0.55 -0.24 -0.70 0.00 0.00 0.00 175.10 175.01 1req s GLU 165 N -0.24 1.53 0.16 2.72 2.12 0.91 -1.59 118.70 124.32 1req s GLU 165 Ca 0.03 -1.29 0.07 0.00 0.36 0.00 0.00 54.97 54.14 1req s GLU 165 Cb -0.13 -1.97 -0.04 0.00 0.26 0.00 0.00 34.13 32.25 1req s GLU 165 CO 0.03 0.46 -0.15 0.14 -0.54 0.00 0.00 175.26 175.20 1req s VAL 166 N -1.07 1.57 0.07 3.70 -7.23 -1.04 -2.15 120.40 114.25 1req s VAL 166 Ca 0.15 -1.95 -0.15 0.00 -1.81 0.00 0.00 61.98 58.22 1req s VAL 166 Cb -0.10 -1.80 0.03 0.00 0.56 0.00 0.00 36.38 35.06 1req s VAL 166 CO 0.07 -0.47 0.35 0.72 -0.31 0.00 0.00 175.10 175.46 1req s PHE 167 N -2.48 -0.15 -0.06 2.82 -0.71 -0.78 -3.75 117.98 112.87 1req s PHE 167 Ca 0.16 -0.04 -0.12 0.00 -1.04 0.00 0.00 56.93 55.89 1req s PHE 167 Cb -0.03 0.16 0.02 0.00 -1.21 0.00 0.00 43.02 41.96 1req s PHE 167 CO 0.05 -0.58 0.29 0.45 -1.34 0.00 0.00 175.22 174.08 1req s SER 168 N -2.34 -0.23 -0.08 1.98 0.15 -1.26 -0.68 113.70 111.24 1req s SER 168 Ca -0.02 0.31 0.17 0.00 0.70 0.00 0.00 55.95 57.11 1req s SER 168 Cb 0.01 0.45 -0.23 0.00 -1.71 0.00 0.00 66.02 64.53 1req s SER 168 CO -0.06 -0.27 0.43 0.54 1.20 0.00 0.00 173.24 175.07 1req n ARG 169 N 2.10 0.66 0.00 5.44 1.74 -1.26 -4.67 116.66 120.66 1req n ARG 169 Ca -0.17 0.07 0.04 0.00 -0.77 0.00 0.00 57.85 57.02 1req n ARG 169 Cb 0.57 -1.64 -0.05 0.00 -1.02 0.00 0.00 32.46 30.32 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 -2.76 0.00 -2.73 -1.55 4.01 -1.26 -4.86 117.16 108.01 1req n TYR 170 Ca -0.20 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.52 1req n TYR 170 Cb 0.97 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 40.02 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 -1.77 -0.62 0.11 7.72 2.15 -1.26 -5.06 116.67 117.94 1req s ASP 171 Ca 0.03 -0.66 -0.17 0.00 0.43 0.00 0.00 52.55 52.18 1req s ASP 171 Cb 0.06 0.81 -0.04 0.00 -0.30 0.00 0.00 42.92 43.45 1req s ASP 171 CO 0.34 -0.03 1.58 1.56 -0.17 0.00 0.00 175.17 178.45 1req h GLN 172 N 4.69 0.57 -0.46 4.34 4.20 -1.92 -2.85 115.11 123.68 1req h GLN 172 Ca 0.01 -0.16 0.04 0.00 0.06 0.00 0.00 58.65 58.60 1req h GLN 172 Cb 1.16 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.84 1req h GLN 172 CO -0.07 0.66 0.22 0.78 -0.67 0.00 0.00 178.83 179.76 1req h GLY 173 N 0.40 0.64 0.37 3.46 0.00 -1.97 0.34 103.07 106.31 1req h GLY 173 Ca 0.10 -0.15 0.09 0.00 0.00 0.00 0.00 47.33 47.37 1req h GLY 173 CO 0.01 0.10 0.22 0.00 0.00 0.00 0.00 176.54 176.86 1req h ALA 174 N 1.26 0.77 0.10 3.60 0.00 -1.97 0.42 119.26 123.43 1req h ALA 174 Ca 0.20 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 1req h ALA 174 Cb 0.12 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1req h ALA 174 CO -0.15 -0.20 -0.05 0.00 0.00 0.00 0.00 179.25 178.85 1req h ALA 175 N 1.42 -0.13 0.15 0.00 0.00 -1.06 0.09 119.26 119.74 1req h ALA 175 Ca 0.31 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1req h ALA 175 Cb 0.38 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1req h ALA 175 CO -0.31 -0.47 -0.31 0.00 0.00 0.00 0.00 179.25 178.15 1req h ALA 176 N 0.56 -0.55 -0.28 0.00 0.00 0.13 0.70 119.26 119.81 1req h ALA 176 Ca -0.01 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.90 1req h ALA 176 Cb 0.27 0.50 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 1req h ALA 176 CO 0.02 -0.86 -0.41 1.49 0.00 0.00 0.00 179.25 179.49 1req h GLU 177 N -0.55 -0.37 -0.32 0.00 4.57 -0.98 0.25 114.58 117.17 1req h GLU 177 Ca 0.02 0.03 0.07 0.00 -1.18 0.00 0.00 59.36 58.30 1req h GLU 177 Cb 0.57 0.09 -0.07 0.00 -0.16 0.00 0.00 28.75 29.17 1req h GLU 177 CO -0.16 -0.25 -0.14 0.00 -1.18 0.00 0.00 179.01 177.28 1req h ALA 178 N 0.34 0.12 -0.33 2.92 0.00 -0.68 0.57 119.26 122.20 1req h ALA 178 Ca 0.11 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 1req h ALA 178 Cb 0.59 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1req h ALA 178 CO -0.49 -0.53 -0.17 1.25 0.00 0.00 0.00 179.25 179.31 1req h LEU 179 N -0.09 0.72 -0.78 0.00 5.85 -0.25 -2.73 115.31 118.04 1req h LEU 179 Ca 0.16 -0.41 -0.07 0.00 0.84 0.00 0.00 57.88 58.40 1req h LEU 179 Cb 0.34 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 1req h LEU 179 CO -0.38 0.97 0.13 -0.37 -0.34 0.00 0.00 178.44 178.46 1req h VAL 180 N 0.46 1.26 -0.34 1.05 -1.51 -0.29 -2.51 116.25 114.38 1req h VAL 180 Ca 0.07 -0.98 0.06 0.00 -1.23 0.00 0.00 66.70 64.62 1req h VAL 180 Cb 0.71 0.61 -0.06 0.00 -2.13 0.00 0.00 31.29 30.43 1req h VAL 180 CO 0.05 0.37 -0.03 0.28 -1.23 0.00 0.00 177.57 177.01 1req h SER 181 N 1.00 -0.19 -0.53 4.19 0.02 -0.92 0.30 113.55 117.41 1req h SER 181 Ca 0.20 0.09 0.10 0.00 -0.84 0.00 0.00 61.79 61.34 1req h SER 181 Cb 0.39 0.16 -0.09 0.00 0.14 0.00 0.00 62.40 63.01 1req h SER 181 CO 0.01 -0.06 0.02 0.58 -1.14 0.00 0.00 176.83 176.24 1req h VAL 182 N 0.06 0.60 -0.40 2.27 2.07 -1.14 -0.64 116.25 119.07 1req h VAL 182 Ca 0.16 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.58 1req h VAL 182 Cb 0.23 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1req h VAL 182 CO -0.30 0.03 0.05 1.88 0.02 0.00 0.00 177.57 179.25 1req h TYR 183 N 0.14 0.72 -0.42 1.57 -1.99 -1.00 -3.14 116.97 112.84 1req h TYR 183 Ca 0.27 -0.11 0.02 0.00 2.00 0.00 0.00 58.73 60.92 1req h TYR 183 Cb 0.41 -0.19 -0.02 0.00 2.00 0.00 0.00 36.73 38.93 1req h TYR 183 CO -0.31 0.71 0.28 0.93 -0.00 0.00 0.00 178.16 179.78 1req h GLU 184 N 0.52 0.49 -0.00 4.88 5.08 0.14 -2.14 114.58 123.55 1req h GLU 184 Ca 0.12 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1req h GLU 184 Cb 0.39 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1req h GLU 184 CO 0.01 0.33 -0.05 0.54 -1.00 0.00 0.00 179.01 178.84 1req n ARG 185 N -4.48 0.95 -2.04 2.33 1.74 -0.30 -4.91 116.66 109.97 1req n ARG 185 Ca 0.04 -0.28 -0.31 0.00 -0.77 0.00 0.00 57.85 56.52 1req n ARG 185 Cb 0.11 -1.49 -0.00 0.00 -1.02 0.00 0.00 32.46 30.05 1req n ARG 185 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1req s SER 186 N -2.24 6.27 -0.44 0.55 1.04 -0.81 -4.99 113.70 113.09 1req s SER 186 Ca 0.37 1.51 0.04 0.00 0.48 0.00 0.00 55.95 58.35 1req s SER 186 Cb 0.21 -2.49 0.61 0.00 0.10 0.00 0.00 66.02 64.45 1req s SER 186 CO 0.41 -0.84 1.82 -0.90 0.98 0.00 0.00 173.24 174.72 1req n ASP 187 N -2.34 3.94 -4.62 7.02 5.68 -1.26 -4.87 116.55 120.10 1req n ASP 187 Ca 0.06 -3.67 -0.34 0.00 -0.50 0.00 0.00 54.79 50.35 1req n ASP 187 Cb 0.54 -0.80 -0.10 0.00 -1.14 0.00 0.00 41.12 39.61 1req n ASP 187 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1req s LYS 188 N -3.36 2.75 -0.28 0.11 3.01 -1.26 -5.04 119.74 115.67 1req s LYS 188 Ca 0.55 -0.57 -0.41 0.00 -1.01 0.00 0.00 55.97 54.54 1req s LYS 188 Cb 0.47 -2.62 -0.16 0.00 -1.01 0.00 0.00 37.83 34.51 1req s LYS 188 CO 0.07 0.65 1.70 -2.30 0.51 0.00 0.00 175.35 175.98 1req n PRO 189 N 1.95 0.99 -0.28 -1.68 -0.02 -1.26 -4.88 135.00 129.83 1req n PRO 189 Ca -0.17 0.36 0.02 0.00 -2.02 0.00 0.00 63.50 61.70 1req n PRO 189 Cb 0.53 -2.02 0.10 0.00 -0.02 0.00 0.00 33.50 32.09 1req n PRO 189 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1req h ALA 190 N 6.74 0.53 0.00 3.55 0.00 -1.92 -1.53 119.26 126.63 1req h ALA 190 Ca -0.46 0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1req h ALA 190 Cb 1.33 0.61 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1req h ALA 190 CO 0.95 -0.40 0.09 1.17 0.00 0.00 0.00 179.25 181.05 1req n LYS 191 N -5.52 0.10 0.06 0.00 3.00 -0.90 -2.24 118.16 112.65 1req n LYS 191 Ca 0.11 0.58 0.11 0.00 -0.00 0.00 0.00 58.31 59.11 1req n LYS 191 Cb 0.41 -1.90 -0.03 0.00 0.00 0.00 0.00 35.03 33.50 1req n LYS 191 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1req n ASP 192 N -2.02 0.58 -4.76 3.14 9.92 -0.58 -3.53 116.55 119.30 1req n ASP 192 Ca -0.01 0.12 -0.36 0.00 -0.53 0.00 0.00 54.79 54.01 1req n ASP 192 Cb 0.11 0.90 -0.07 0.00 -0.64 0.00 0.00 41.12 41.42 1req n ASP 192 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1req s LEU 193 N -4.81 4.27 0.02 0.64 1.43 -0.95 -4.69 118.68 114.59 1req s LEU 193 Ca -0.01 0.43 0.07 0.00 -1.03 0.00 0.00 54.13 53.58 1req s LEU 193 Cb 0.12 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.08 1req s LEU 193 CO 0.82 0.20 -0.20 0.00 0.23 0.00 0.00 176.35 177.40 1req s ALA 194 N 0.07 2.49 -0.08 4.21 0.00 -1.26 -2.13 121.76 125.06 1req s ALA 194 Ca 0.13 -1.15 -0.24 0.00 0.00 0.00 0.00 51.96 50.70 1req s ALA 194 Cb -0.12 -0.71 0.05 0.00 0.00 0.00 0.00 23.12 22.34 1req s ALA 194 CO 0.02 0.56 0.55 -0.48 0.00 0.00 0.00 175.76 176.41 1req s LEU 195 N -1.15 -0.11 -0.18 0.00 2.34 -1.26 -3.77 118.68 114.55 1req s LEU 195 Ca 0.13 0.64 -0.02 0.00 0.06 0.00 0.00 54.13 54.94 1req s LEU 195 Cb -0.10 2.03 -0.01 0.00 -0.56 0.00 0.00 46.19 47.55 1req s LEU 195 CO 0.03 -0.46 -0.08 0.20 -1.06 0.00 0.00 176.35 174.98 1req s ASN 196 N -0.86 4.23 0.14 1.48 -0.87 -0.62 -1.51 114.94 116.92 1req s ASN 196 Ca -0.09 -0.34 0.12 0.00 -1.57 0.00 0.00 52.86 50.98 1req s ASN 196 Cb -0.02 -1.69 -0.11 0.00 -0.02 0.00 0.00 41.25 39.41 1req s ASN 196 CO 0.06 0.07 1.17 -0.07 -2.57 0.00 0.00 177.10 175.76 1req h LEU 197 N 7.43 0.00 -0.15 0.60 3.38 -1.11 -2.76 115.31 122.70 1req h LEU 197 Ca -0.35 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.56 1req h LEU 197 Cb 1.18 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.94 1req h LEU 197 CO 0.59 0.75 -0.08 0.61 0.09 0.00 0.00 178.44 180.40 1req n GLY 198 N 1.34 0.45 3.76 0.83 0.00 -1.13 -4.43 105.19 106.01 1req n GLY 198 Ca -0.03 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 44.91 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 -1.28 4.58 -0.42 0.99 2.01 0.08 -4.52 118.68 120.12 1req s LEU 199 Ca 0.03 2.08 0.00 0.00 0.01 0.00 0.00 54.13 56.26 1req s LEU 199 Cb -0.02 -3.65 0.20 0.00 0.01 0.00 0.00 46.19 42.73 1req s LEU 199 CO 0.04 0.01 0.89 -0.62 1.01 0.00 0.00 176.35 177.68 1req s ASP 200 N -1.08 -0.91 0.35 2.29 2.15 -1.26 -1.83 116.67 116.37 1req s ASP 200 Ca 0.43 -0.93 0.07 0.00 0.43 0.00 0.00 52.55 52.55 1req s ASP 200 Cb -0.28 1.19 0.66 0.00 -0.30 0.00 0.00 42.92 44.19 1req s ASP 200 CO 0.35 -0.05 1.86 1.55 -0.17 0.00 0.00 175.17 178.71 1req h PRO 201 N 5.03 0.35 -0.10 4.34 0.13 -1.93 0.74 132.00 140.56 1req h PRO 201 Ca 0.02 -0.09 -0.17 0.00 -0.87 0.00 0.00 66.00 64.89 1req h PRO 201 Cb 1.15 -0.04 0.01 0.00 0.13 0.00 0.00 31.00 32.25 1req h PRO 201 CO -0.03 0.49 -0.62 0.82 -0.23 0.00 0.00 178.00 178.43 1req h ILE 202 N 0.33 1.34 -0.66 -3.56 2.04 -1.95 -1.42 117.51 113.63 1req h ILE 202 Ca 0.06 -1.91 0.03 0.00 1.00 0.00 0.00 64.86 64.04 1req h ILE 202 Cb 0.43 2.19 -0.04 0.00 -0.74 0.00 0.00 36.82 38.65 1req h ILE 202 CO 0.02 0.58 0.41 1.23 0.00 0.00 0.00 178.15 180.40 1req h GLY 203 N 0.23 0.95 0.97 5.37 0.00 -1.88 -0.11 103.07 108.60 1req h GLY 203 Ca -0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 1req h GLY 203 CO 0.13 0.26 0.23 -2.75 0.00 0.00 0.00 176.54 174.40 1req h PHE 204 N 0.80 0.64 0.11 5.60 3.57 -0.84 -2.41 116.94 124.40 1req h PHE 204 Ca 0.27 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.75 1req h PHE 204 Cb 0.02 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.54 1req h PHE 204 CO -0.05 0.50 -0.17 0.00 -2.23 0.00 0.00 178.31 176.36 1req h ALA 205 N 1.07 -0.30 -0.81 2.41 0.00 -0.30 0.30 119.26 121.63 1req h ALA 205 Ca 0.16 -0.03 0.17 0.00 0.00 0.00 0.00 54.91 55.21 1req h ALA 205 Cb 0.09 0.27 -0.11 0.00 0.00 0.00 0.00 17.79 18.05 1req h ALA 205 CO -0.02 -0.70 0.33 0.00 0.00 0.00 0.00 179.25 178.86 1req h ALA 206 N 0.49 1.19 -0.09 0.00 0.00 -1.04 0.56 119.26 120.36 1req h ALA 206 Ca 0.02 0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.92 1req h ALA 206 Cb 0.36 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1req h ALA 206 CO -0.09 -0.24 -0.58 -0.07 0.00 0.00 0.00 179.25 178.27 1req h LEU 207 N 0.44 0.33 0.00 0.00 3.38 -0.84 0.24 115.31 118.85 1req h LEU 207 Ca 0.46 -0.18 -0.15 0.00 0.09 0.00 0.00 57.88 58.11 1req h LEU 207 Cb 0.77 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1req h LEU 207 CO -0.45 0.84 -1.34 1.56 0.09 0.00 0.00 178.44 179.14 1req h GLN 208 N 0.22 0.00 -0.95 1.13 1.08 0.95 -2.21 115.11 115.33 1req h GLN 208 Ca -0.00 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 1req h GLN 208 Cb 1.08 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.52 1req h GLN 208 CO 0.09 0.26 -0.08 0.41 -0.95 0.00 0.00 178.83 178.56 1req n GLY 209 N 1.36 0.49 3.85 3.46 0.00 0.18 -3.28 105.19 111.25 1req n GLY 209 Ca -0.08 -0.68 -0.29 0.00 0.00 0.00 0.00 46.02 44.97 1req n GLY 209 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1req s THR 210 N -2.55 1.44 -0.09 2.61 -4.23 -1.13 -4.89 115.64 106.80 1req s THR 210 Ca 0.03 -1.70 -0.17 0.00 -1.18 0.00 0.00 61.69 58.67 1req s THR 210 Cb -0.02 -2.14 -0.05 0.00 1.34 0.00 0.00 72.50 71.64 1req s THR 210 CO 0.04 0.00 0.46 -1.83 -0.54 0.00 0.00 174.62 172.75 1req s GLU 211 N -4.11 4.26 0.16 3.99 1.03 -1.26 -4.63 118.70 118.14 1req s GLU 211 Ca 0.22 0.44 -0.31 0.00 0.03 0.00 0.00 54.97 55.34 1req s GLU 211 Cb -0.01 -3.39 -0.10 0.00 -0.80 0.00 0.00 34.13 29.84 1req s GLU 211 CO 0.13 0.27 1.53 -1.25 -1.33 0.00 0.00 175.26 174.61 1req s PRO 212 N 0.25 4.24 -0.50 -4.83 0.04 -1.26 -4.87 135.00 128.06 1req s PRO 212 Ca 0.25 2.31 -0.00 0.00 0.04 0.00 0.00 61.00 63.60 1req s PRO 212 Cb -0.15 -3.17 0.13 0.00 0.04 0.00 0.00 34.50 31.35 1req s PRO 212 CO 0.11 -0.56 0.27 0.34 0.04 0.00 0.00 177.00 177.20 1req s ASP 213 N 1.06 4.97 -0.03 6.66 2.15 -1.26 -4.98 116.67 125.24 1req s ASP 213 Ca 0.68 -2.56 0.13 0.00 0.43 0.00 0.00 52.55 51.23 1req s ASP 213 Cb -0.42 -1.77 0.42 0.00 -0.30 0.00 0.00 42.92 40.85 1req s ASP 213 CO 0.32 -0.39 1.32 0.18 -0.17 0.00 0.00 175.17 176.43 1req n LEU 214 N 3.83 2.69 0.15 -1.34 4.32 -1.26 -4.37 117.00 121.02 1req n LEU 214 Ca 0.04 -1.35 0.11 0.00 -0.02 0.00 0.00 56.01 54.79 1req n LEU 214 Cb 0.38 -0.36 0.07 0.00 -1.62 0.00 0.00 43.42 41.89 1req n LEU 214 CO 0.32 0.58 0.35 0.71 -1.22 0.00 0.00 177.39 178.13 1req h THR 215 N 2.61 0.02 -0.00 -5.08 1.35 -1.96 -3.31 112.91 106.53 1req h THR 215 Ca 0.00 -1.03 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 1req h THR 215 Cb 0.75 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 1req h THR 215 CO 0.06 0.01 -0.08 0.52 -0.25 0.00 0.00 175.52 175.78 1req n VAL 216 N -2.86 0.00 0.16 6.82 0.31 -1.26 -4.34 118.33 117.17 1req n VAL 216 Ca 0.02 -0.04 -0.14 0.00 -0.01 0.00 0.00 64.34 64.16 1req n VAL 216 Cb 0.55 -0.21 -0.07 0.00 -0.91 0.00 0.00 33.84 33.20 1req n VAL 216 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1req h LEU 217 N 0.41 -0.81 -0.64 7.52 3.38 -1.88 -1.94 115.31 121.34 1req h LEU 217 Ca 0.00 0.08 0.13 0.00 0.09 0.00 0.00 57.88 58.18 1req h LEU 217 Cb 0.32 0.29 -0.12 0.00 0.09 0.00 0.00 40.66 41.24 1req h LEU 217 CO 0.00 -0.41 -0.14 1.23 0.09 0.00 0.00 178.44 179.21 1req h GLY 218 N -0.58 0.49 -0.73 0.83 0.00 -1.86 -0.25 103.07 100.97 1req h GLY 218 Ca 0.00 0.20 0.07 0.00 0.00 0.00 0.00 47.33 47.60 1req h GLY 218 CO -0.10 -0.24 -0.52 -1.80 0.00 0.00 0.00 176.54 173.87 1req h ASP 219 N 0.01 -1.87 -0.71 0.19 3.58 -1.72 -2.31 116.42 113.58 1req h ASP 219 Ca 0.31 0.27 0.07 0.00 0.42 0.00 0.00 57.03 58.10 1req h ASP 219 Cb 0.48 0.81 -0.04 0.00 1.72 0.00 0.00 39.33 42.30 1req h ASP 219 CO -0.65 -0.26 0.47 -0.50 -2.88 0.00 0.00 179.24 175.42 1req h TRP 220 N -0.12 0.73 -0.14 0.28 -0.00 -0.31 -1.10 115.95 115.30 1req h TRP 220 Ca 0.12 0.02 -0.08 0.00 -0.00 0.00 0.00 58.89 58.95 1req h TRP 220 Cb 0.42 -0.24 -0.01 0.00 -0.00 0.00 0.00 29.16 29.33 1req h TRP 220 CO -0.92 0.38 -0.25 0.28 -0.00 0.00 0.00 178.44 177.93 1req h VAL 221 N 0.72 1.24 0.05 1.49 2.07 -0.96 -3.00 116.25 117.85 1req h VAL 221 Ca 0.31 -1.13 -0.24 0.00 0.82 0.00 0.00 66.70 66.47 1req h VAL 221 Cb 0.28 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1req h VAL 221 CO -0.10 0.34 -1.04 0.03 0.02 0.00 0.00 177.57 176.82 1req h ARG 222 N 0.23 0.31 0.00 1.57 3.08 -0.69 -3.09 114.38 115.80 1req h ARG 222 Ca 0.04 -0.40 -0.01 0.00 0.07 0.00 0.00 59.98 59.68 1req h ARG 222 Cb 0.58 0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.75 1req h ARG 222 CO 0.04 1.12 -0.04 -0.09 -1.07 0.00 0.00 179.97 179.92 1req h ARG 223 N 0.15 0.00 -0.59 0.04 9.65 -1.24 -1.74 114.38 120.65 1req h ARG 223 Ca -0.09 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.79 1req h ARG 223 Cb 1.71 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.29 1req h ARG 223 CO 0.17 0.04 0.00 -0.11 2.80 0.00 0.00 179.97 182.88 1req n LEU 224 N -4.19 4.95 0.10 3.80 7.94 -1.14 -4.39 117.00 124.08 1req n LEU 224 Ca -0.03 -2.63 -0.03 0.00 -1.11 0.00 0.00 56.01 52.22 1req n LEU 224 Cb 0.13 -0.60 0.00 0.00 0.53 0.00 0.00 43.42 43.48 1req n LEU 224 CO 0.32 0.75 0.33 0.00 -1.11 0.00 0.00 177.39 177.67 1req h ALA 225 N 3.82 0.59 -0.49 1.96 0.00 -1.23 -3.15 119.26 120.76 1req h ALA 225 Ca 0.00 -0.69 0.09 0.00 0.00 0.00 0.00 54.91 54.31 1req h ALA 225 Cb 1.60 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 19.19 1req h ALA 225 CO 0.31 0.95 0.02 0.87 0.00 0.00 0.00 179.25 181.40 1req h LYS 226 N 0.00 0.13 -7.72 0.00 1.57 -1.77 -3.45 116.57 105.33 1req h LYS 226 Ca -0.01 -0.01 -0.45 0.00 -1.87 0.00 0.00 60.65 58.31 1req h LYS 226 Cb 1.49 -0.03 0.14 0.00 0.08 0.00 0.00 32.23 33.91 1req h LYS 226 CO 0.10 0.09 0.40 -0.06 -0.57 0.00 0.00 179.45 179.40 1req s PHE 227 N -6.16 1.94 0.99 -1.35 0.08 -1.19 -2.11 117.98 110.18 1req s PHE 227 Ca -0.13 0.39 -0.17 0.00 0.12 0.00 0.00 56.93 57.13 1req s PHE 227 Cb 0.16 -3.89 -0.08 0.00 -0.57 0.00 0.00 43.02 38.64 1req s PHE 227 CO 0.72 -2.36 -0.43 0.45 -0.10 0.00 0.00 175.22 173.50 1req n SER 228 N -3.59 -4.18 0.10 1.36 2.88 -0.91 -4.70 113.62 104.59 1req n SER 228 Ca 0.13 0.19 0.12 0.00 -1.33 0.00 0.00 58.87 57.98 1req n SER 228 Cb 0.60 -0.89 0.45 0.00 -0.75 0.00 0.00 64.21 63.62 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 0.79 0.19 0.21 -1.46 -0.04 -1.26 -2.69 135.00 130.74 1req n PRO 229 Ca 0.01 0.30 0.14 0.00 -0.04 0.00 0.00 63.50 63.91 1req n PRO 229 Cb 0.58 -1.79 0.46 0.00 -0.04 0.00 0.00 33.50 32.70 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 3.32 -1.93 -3.46 116.42 114.02 1req h ASP 230 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1req h ASP 230 Cb 0.52 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.13 1req h ASP 230 CO 0.00 0.00 0.64 -0.44 -1.72 0.00 0.00 179.24 177.72 1req s SER 231 N -5.46 6.77 -0.03 6.45 0.01 -1.10 -4.78 113.70 115.57 1req s SER 231 Ca 0.05 2.69 0.02 0.00 1.31 0.00 0.00 55.95 60.01 1req s SER 231 Cb 0.08 -2.65 0.01 0.00 0.21 0.00 0.00 66.02 63.68 1req s SER 231 CO 0.57 -0.54 -0.06 -0.13 0.41 0.00 0.00 173.24 173.49 1req s ARG 232 N -1.76 0.77 -0.07 12.44 1.81 -0.57 -4.72 118.95 126.85 1req s ARG 232 Ca 0.49 -0.17 -0.22 0.00 -1.72 0.00 0.00 55.73 54.11 1req s ARG 232 Cb -0.40 -0.76 -0.30 0.00 -0.45 0.00 0.00 34.95 33.04 1req s ARG 232 CO 0.53 0.00 0.85 0.00 -0.68 0.00 0.00 175.30 176.00 1req h ALA 233 N 6.76 -0.06 -3.17 2.13 0.00 -1.60 0.17 119.26 123.49 1req h ALA 233 Ca -0.35 -0.70 -0.63 0.00 0.00 0.00 0.00 54.91 53.23 1req h ALA 233 Cb 1.16 0.12 -0.13 0.00 0.00 0.00 0.00 17.79 18.94 1req h ALA 233 CO 0.48 0.36 -0.54 0.08 0.00 0.00 0.00 179.25 179.63 1req s VAL 234 N -2.40 5.00 -0.34 0.00 1.01 -1.00 -0.74 120.40 121.92 1req s VAL 234 Ca -0.15 0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.87 1req s VAL 234 Cb 0.01 -3.23 0.11 0.00 0.00 0.00 0.00 36.38 33.26 1req s VAL 234 CO 0.81 0.50 0.11 -0.89 0.00 0.00 0.00 175.10 175.63 1req s THR 235 N -0.03 1.36 -0.44 3.92 2.01 -0.76 -0.70 115.64 121.00 1req s THR 235 Ca 0.07 -1.87 -0.27 0.00 0.31 0.00 0.00 61.69 59.93 1req s THR 235 Cb -0.12 -2.00 -0.03 0.00 0.01 0.00 0.00 72.50 70.35 1req s THR 235 CO 0.01 -0.69 1.98 -0.63 -0.69 0.00 0.00 174.62 174.59 1req s ILE 236 N 1.19 3.30 -0.85 1.82 1.01 0.43 -4.48 121.20 123.62 1req s ILE 236 Ca 0.11 0.25 -0.25 0.00 0.00 0.00 0.00 60.65 60.77 1req s ILE 236 Cb -0.19 -3.55 0.05 0.00 0.01 0.00 0.00 42.46 38.78 1req s ILE 236 CO -0.16 -0.45 1.31 -0.62 0.00 0.00 0.00 174.94 175.02 1req s ASP 237 N 8.11 6.32 0.03 3.58 -1.08 -1.26 -1.71 116.67 130.65 1req s ASP 237 Ca 0.81 -0.95 0.28 0.00 -0.52 0.00 0.00 52.55 52.17 1req s ASP 237 Cb -0.20 -2.55 1.03 0.00 -1.46 0.00 0.00 42.92 39.75 1req s ASP 237 CO 0.28 -1.64 1.80 0.00 0.52 0.00 0.00 175.17 176.13 1req n ALA 238 N 8.93 2.56 0.23 3.66 0.00 -0.48 -2.79 120.51 132.62 1req n ALA 238 Ca 0.15 -0.14 0.10 0.00 0.00 0.00 0.00 53.44 53.55 1req n ALA 238 Cb 0.50 -1.40 0.52 0.00 0.00 0.00 0.00 19.45 19.07 1req n ALA 238 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1req h ASN 239 N 0.00 0.00 -0.11 0.00 -0.73 -1.85 -2.12 115.58 110.78 1req h ASN 239 Ca 0.00 0.00 0.04 0.00 1.87 0.00 0.00 56.30 58.21 1req h ASN 239 Cb 0.54 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 39.09 1req h ASN 239 CO 0.00 0.21 -0.14 0.40 -0.37 0.00 0.00 177.43 177.53 1req h ILE 240 N 0.00 0.62 -0.52 2.57 2.04 -1.86 0.22 117.51 120.58 1req h ILE 240 Ca -0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 1req h ILE 240 Cb 0.65 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1req h ILE 240 CO 0.03 0.00 0.17 1.88 0.00 0.00 0.00 178.15 180.22 1req h TYR 241 N -0.19 0.83 -0.31 1.37 0.05 -1.59 -3.21 116.97 113.93 1req h TYR 241 Ca 0.08 -0.08 0.07 0.00 0.05 0.00 0.00 58.73 58.85 1req h TYR 241 Cb 0.31 -0.24 -0.07 0.00 1.01 0.00 0.00 36.73 37.74 1req h TYR 241 CO -0.25 0.71 -0.13 1.25 -1.05 0.00 0.00 178.16 178.69 1req h HIS 242 N 0.71 -0.32 0.00 4.88 -0.00 -1.25 -1.16 115.15 118.01 1req h HIS 242 Ca 0.17 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.57 1req h HIS 242 Cb 0.27 0.19 0.00 0.00 -0.00 0.00 0.00 27.41 27.87 1req h HIS 242 CO 0.01 -0.20 0.06 -0.91 -0.00 0.00 0.00 177.93 176.89 1req h ASN 243 N -0.08 0.00 -0.05 3.26 2.35 -1.00 0.25 115.58 120.31 1req h ASN 243 Ca 0.16 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1req h ASN 243 Cb 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1req h ASN 243 CO -0.36 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.42 1req n ALA 244 N -2.02 2.48 0.00 -0.83 0.00 -0.96 -3.31 120.51 115.87 1req n ALA 244 Ca -0.03 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1req n ALA 244 Cb 0.12 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.68 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 1.32 0.99 3.73 0.00 0.00 0.88 -4.90 105.19 107.21 1req n GLY 245 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.00 2.11 0.57 4.61 0.00 -0.48 -4.37 121.76 122.20 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 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.71 1req s ALA 246 CO 0.00 -1.88 0.00 0.41 0.00 0.00 0.00 175.76 174.29 1req n GLY 247 N 0.01 0.65 0.16 0.00 0.00 -1.26 -4.50 105.19 100.24 1req n GLY 247 Ca 0.12 -1.77 -0.19 0.00 0.00 0.00 0.00 46.02 44.19 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 0.00 0.67 -0.29 1.61 3.32 -1.98 -3.15 116.42 116.60 1req h ASP 248 Ca 0.00 -0.77 -0.00 0.00 0.02 0.00 0.00 57.03 56.27 1req h ASP 248 Cb 0.00 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1req h ASP 248 CO 0.00 1.36 0.16 0.58 -1.72 0.00 0.00 179.24 179.62 1req h VAL 249 N 0.06 1.12 -0.31 -1.35 2.07 -1.93 -2.78 116.25 113.14 1req h VAL 249 Ca -0.11 -0.32 -0.15 0.00 0.82 0.00 0.00 66.70 66.95 1req h VAL 249 Cb 1.50 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1req h VAL 249 CO 0.16 0.12 -0.37 0.00 0.02 0.00 0.00 177.57 177.50 1req h ALA 250 N 1.04 0.46 -0.70 1.67 0.00 -1.94 -1.68 119.26 118.12 1req h ALA 250 Ca 0.10 -0.44 0.03 0.00 0.00 0.00 0.00 54.91 54.60 1req h ALA 250 Cb 0.05 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1req h ALA 250 CO -0.02 0.55 0.44 1.49 0.00 0.00 0.00 179.25 181.71 1req h GLU 251 N 0.57 0.84 -0.07 0.00 4.81 -1.60 0.18 114.58 119.30 1req h GLU 251 Ca 0.04 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.17 1req h GLU 251 Cb 0.96 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.16 1req h GLU 251 CO 0.09 0.55 -0.14 1.25 -0.73 0.00 0.00 179.01 180.03 1req h LEU 252 N 0.86 0.25 -0.30 1.64 5.85 -1.45 -2.07 115.31 120.08 1req h LEU 252 Ca 0.28 -0.56 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1req h LEU 252 Cb 0.01 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1req h LEU 252 CO -0.10 0.76 0.16 0.00 -0.34 0.00 0.00 178.44 178.92 1req h ALA 253 N 0.50 0.39 0.00 1.25 0.00 -1.11 -2.72 119.26 117.56 1req h ALA 253 Ca 0.00 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 1req h ALA 253 Cb 0.72 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1req h ALA 253 CO 0.03 -0.07 -0.45 -1.49 0.00 0.00 0.00 179.25 177.27 1req h TRP 254 N 0.36 0.00 0.01 0.00 6.55 -0.72 -0.48 115.95 121.68 1req h TRP 254 Ca 0.10 0.00 -0.00 0.00 0.95 0.00 0.00 58.89 59.94 1req h TRP 254 Cb 0.08 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.38 1req h TRP 254 CO -0.03 0.45 -0.00 0.00 -1.05 0.00 0.00 178.44 177.81 1req h ALA 255 N 1.55 -0.01 -0.21 1.49 0.00 -1.17 -0.89 119.26 120.01 1req h ALA 255 Ca -0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1req h ALA 255 Cb 1.11 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1req h ALA 255 CO 0.06 -0.49 0.09 -0.07 0.00 0.00 0.00 179.25 178.84 1req h LEU 256 N -0.05 0.29 -0.44 0.00 3.38 -1.17 -1.49 115.31 115.83 1req h LEU 256 Ca -0.00 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.84 1req h LEU 256 Cb 0.05 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 1req h LEU 256 CO 0.00 0.37 0.22 0.00 0.09 0.00 0.00 178.44 179.13 1req h ALA 257 N 0.93 0.55 -0.28 1.53 0.00 -1.08 -0.50 119.26 120.41 1req h ALA 257 Ca 0.07 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1req h ALA 257 Cb 0.17 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1req h ALA 257 CO -0.01 -0.13 0.16 1.15 0.00 0.00 0.00 179.25 180.43 1req h THR 258 N 0.45 1.12 -0.05 0.00 2.02 -1.11 -2.60 112.91 112.72 1req h THR 258 Ca 0.19 -0.30 0.03 0.00 0.77 0.00 0.00 66.41 67.10 1req h THR 258 Cb 0.08 0.80 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 1req h THR 258 CO -0.13 0.12 -0.16 1.23 0.37 0.00 0.00 175.52 176.95 1req h GLY 259 N 0.35 -0.16 0.53 2.16 0.00 -0.44 -2.11 103.07 103.41 1req h GLY 259 Ca 0.10 0.19 0.03 0.00 0.00 0.00 0.00 47.33 47.65 1req h GLY 259 CO -0.02 -0.15 -0.16 0.00 0.00 0.00 0.00 176.54 176.21 1req h ALA 260 N 0.75 -0.13 -0.47 3.60 0.00 -1.12 -0.13 119.26 121.77 1req h ALA 260 Ca 0.07 0.03 0.10 0.00 0.00 0.00 0.00 54.91 55.11 1req h ALA 260 Cb 0.33 0.30 -0.10 0.00 0.00 0.00 0.00 17.79 18.32 1req h ALA 260 CO -0.19 -0.63 -0.18 0.93 0.00 0.00 0.00 179.25 179.18 1req h GLU 261 N -0.22 -0.08 0.00 0.00 4.39 -1.23 -1.21 114.58 116.24 1req h GLU 261 Ca 0.07 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.74 1req h GLU 261 Cb 0.33 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1req h GLU 261 CO -0.20 -0.05 -0.18 1.88 -1.16 0.00 0.00 179.01 179.30 1req h TYR 262 N -0.08 0.00 0.20 4.33 0.05 -1.02 -0.83 116.97 119.62 1req h TYR 262 Ca 0.23 0.00 -0.27 0.00 0.05 0.00 0.00 58.73 58.73 1req h TYR 262 Cb 0.43 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.20 1req h TYR 262 CO -0.46 0.18 -1.21 0.28 -1.05 0.00 0.00 178.16 175.90 1req h VAL 263 N 0.00 1.36 0.40 -2.88 2.07 -0.40 -2.69 116.25 114.11 1req h VAL 263 Ca -0.00 -2.62 -0.01 0.00 0.82 0.00 0.00 66.70 64.89 1req h VAL 263 Cb 0.62 3.10 -0.01 0.00 -1.52 0.00 0.00 31.29 33.48 1req h VAL 263 CO 0.02 0.77 -0.29 0.03 0.02 0.00 0.00 177.57 178.12 1req h ARG 264 N -0.09 -0.65 -0.97 1.57 3.08 -1.12 -0.93 114.38 115.27 1req h ARG 264 Ca -0.21 0.04 0.17 0.00 0.07 0.00 0.00 59.98 60.05 1req h ARG 264 Cb 1.93 0.15 -0.09 0.00 0.08 0.00 0.00 29.97 32.04 1req h ARG 264 CO 0.21 -0.43 0.61 0.00 -1.07 0.00 0.00 179.97 179.29 1req h ALA 265 N -0.15 1.76 0.03 0.04 0.00 -1.29 -0.86 119.26 118.79 1req h ALA 265 Ca -0.04 0.05 -0.22 0.00 0.00 0.00 0.00 54.91 54.70 1req h ALA 265 Cb 0.58 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1req h ALA 265 CO 0.01 -0.07 -1.05 -0.07 0.00 0.00 0.00 179.25 178.07 1req h LEU 266 N 0.74 0.11 -0.28 0.00 3.38 -1.11 -2.87 115.31 115.27 1req h LEU 266 Ca 0.52 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.29 1req h LEU 266 Cb 0.83 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1req h LEU 266 CO -0.29 1.08 -0.15 0.58 0.09 0.00 0.00 178.44 179.75 1req h VAL 267 N 0.02 1.30 -0.87 1.22 2.07 -0.43 -1.69 116.25 117.87 1req h VAL 267 Ca -0.04 -1.26 0.09 0.00 0.82 0.00 0.00 66.70 66.31 1req h VAL 267 Cb 1.80 1.50 -0.07 0.00 -1.52 0.00 0.00 31.29 33.00 1req h VAL 267 CO 0.15 0.40 0.52 -0.33 0.02 0.00 0.00 177.57 178.32 1req h GLU 268 N 0.35 0.86 -0.97 1.57 5.08 -1.24 -1.90 114.58 118.33 1req h GLU 268 Ca 0.06 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1req h GLU 268 Cb 0.68 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1req h GLU 268 CO 0.04 0.57 0.00 1.04 -1.00 0.00 0.00 179.01 179.66 1req n GLN 269 N -4.68 0.89 -0.53 2.33 6.02 -1.05 -4.84 117.38 115.51 1req n GLN 269 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.13 1req n GLN 269 Cb 0.26 -1.30 0.00 0.00 1.02 0.00 0.00 30.24 30.22 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 0.24 0.70 3.92 1.08 0.00 -0.72 -4.97 105.19 105.45 1req n GLY 270 Ca 0.00 -0.33 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 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 3.42 0.95 1.61 0.08 -0.66 -5.00 117.98 116.37 1req s PHE 271 Ca 0.00 0.08 -0.14 0.00 0.12 0.00 0.00 56.93 57.00 1req s PHE 271 Cb 0.00 -1.63 0.16 0.00 -0.57 0.00 0.00 43.02 40.98 1req s PHE 271 CO 0.00 0.51 1.16 0.95 -0.10 0.00 0.00 175.22 177.74 1req s THR 272 N -1.77 1.95 0.09 0.64 -4.23 -1.26 -3.94 115.64 107.13 1req s THR 272 Ca 0.34 0.00 -0.16 0.00 -1.18 0.00 0.00 61.69 60.69 1req s THR 272 Cb -0.11 -2.76 -0.09 0.00 1.34 0.00 0.00 72.50 70.88 1req s THR 272 CO 0.28 0.00 1.42 0.00 -0.54 0.00 0.00 174.62 175.78 1req h ALA 273 N -1.62 0.39 -0.98 3.99 0.00 -1.93 -2.85 119.26 116.27 1req h ALA 273 Ca -0.49 -0.37 0.25 0.00 0.00 0.00 0.00 54.91 54.30 1req h ALA 273 Cb 1.32 -0.09 -0.13 0.00 0.00 0.00 0.00 17.79 18.89 1req h ALA 273 CO 0.56 0.35 0.54 1.15 0.00 0.00 0.00 179.25 181.85 1req h THR 274 N 0.36 0.49 0.00 0.00 2.02 -1.90 0.15 112.91 114.03 1req h THR 274 Ca 0.05 -0.17 -0.09 0.00 0.77 0.00 0.00 66.41 66.97 1req h THR 274 Cb 0.77 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.12 1req h THR 274 CO 0.06 0.09 -0.43 -0.33 0.37 0.00 0.00 175.52 175.28 1req h GLU 275 N 0.50 0.00 0.06 6.66 5.08 -1.90 -1.71 114.58 123.28 1req h GLU 275 Ca 0.63 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.99 1req h GLU 275 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1req h GLU 275 CO -0.51 0.43 -0.03 0.00 -1.00 0.00 0.00 179.01 177.90 1req h ALA 276 N 1.57 -0.08 -0.54 3.43 0.00 -0.54 -2.98 119.26 120.11 1req h ALA 276 Ca -0.00 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 54.71 1req h ALA 276 Cb 1.07 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1req h ALA 276 CO 0.06 -0.33 0.36 0.74 0.00 0.00 0.00 179.25 180.08 1req h PHE 277 N -0.52 0.63 0.00 0.00 -1.00 -1.11 -1.98 116.94 112.95 1req h PHE 277 Ca -0.01 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.79 1req h PHE 277 Cb 0.46 -0.21 0.00 0.00 3.61 0.00 0.00 35.95 39.81 1req h PHE 277 CO 0.07 0.38 0.00 -0.25 -1.61 0.00 0.00 178.31 176.90 1req n ASP 278 N -4.47 0.02 -0.02 2.17 9.92 -0.65 -2.95 116.55 120.57 1req n ASP 278 Ca 0.06 0.50 0.05 0.00 -0.53 0.00 0.00 54.79 54.88 1req n ASP 278 Cb 0.11 -0.51 -0.06 0.00 -0.64 0.00 0.00 41.12 40.02 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 -1.52 0.00 -3.29 -3.53 5.66 -0.76 -4.82 114.28 106.02 1req n THR 279 Ca 0.05 -0.24 -0.39 0.00 -3.05 0.00 0.00 64.05 60.42 1req n THR 279 Cb 0.24 1.01 -0.07 0.00 -1.55 0.00 0.00 70.33 69.96 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 -2.04 5.14 0.24 1.09 1.01 -1.10 -1.62 121.20 123.91 1req s ILE 280 Ca 0.05 0.88 0.12 0.00 0.00 0.00 0.00 60.65 61.69 1req s ILE 280 Cb 0.09 -3.81 -0.05 0.00 0.01 0.00 0.00 42.46 38.71 1req s ILE 280 CO 0.46 0.21 -0.21 0.20 0.00 0.00 0.00 174.94 175.60 1req s ASN 281 N 1.10 3.58 -0.12 3.58 -0.87 0.12 -4.68 114.94 117.65 1req s ASN 281 Ca 0.23 -0.92 0.01 0.00 -1.57 0.00 0.00 52.86 50.61 1req s ASN 281 Cb -0.15 -0.32 -0.01 0.00 -0.02 0.00 0.00 41.25 40.75 1req s ASN 281 CO 0.09 0.08 -0.17 -0.36 -2.57 0.00 0.00 177.10 174.17 1req s PHE 282 N -2.08 2.72 -0.38 2.20 0.40 -0.24 -0.43 117.98 120.18 1req s PHE 282 Ca 0.26 -0.80 -0.16 0.00 -0.60 0.00 0.00 56.93 55.63 1req s PHE 282 Cb -0.07 -1.80 0.00 0.00 0.51 0.00 0.00 43.02 41.67 1req s PHE 282 CO 0.13 -0.29 0.37 0.50 0.70 0.00 0.00 175.22 176.62 1req s ARG 283 N 0.37 3.32 0.15 0.44 3.52 -0.69 -0.66 118.95 125.40 1req s ARG 283 Ca -0.13 -0.63 0.09 0.00 -0.13 0.00 0.00 55.73 54.92 1req s ARG 283 Cb -0.17 -3.88 -0.04 0.00 -1.56 0.00 0.00 34.95 29.30 1req s ARG 283 CO 0.07 -0.65 -0.20 0.14 -0.81 0.00 0.00 175.30 173.84 1req s VAL 284 N 1.98 1.91 0.28 7.11 -7.23 -0.75 -1.38 120.40 122.33 1req s VAL 284 Ca 0.10 -1.85 -0.29 0.00 -1.81 0.00 0.00 61.98 58.14 1req s VAL 284 Cb -0.17 -1.84 -0.09 0.00 0.56 0.00 0.00 36.38 34.84 1req s VAL 284 CO 0.12 -0.20 0.97 -0.89 -0.31 0.00 0.00 175.10 174.78 1req s THR 285 N -1.74 4.01 -0.28 5.32 2.01 -1.26 -1.34 115.64 122.36 1req s THR 285 Ca 0.14 1.90 -0.07 0.00 0.31 0.00 0.00 61.69 63.98 1req s THR 285 Cb -0.07 -4.16 0.00 0.00 0.01 0.00 0.00 72.50 68.29 1req s THR 285 CO 0.07 0.35 0.07 0.00 -0.69 0.00 0.00 174.62 174.42 1req s ALA 286 N -1.33 3.05 0.00 7.40 0.00 -0.50 -4.86 121.76 125.52 1req s ALA 286 Ca 0.45 -1.40 0.00 0.00 0.00 0.00 0.00 51.96 51.01 1req s ALA 286 Cb -0.25 -2.10 0.00 0.00 0.00 0.00 0.00 23.12 20.77 1req s ALA 286 CO 0.31 -0.85 0.00 0.25 0.00 0.00 0.00 175.76 175.47 1req n THR 287 N 4.86 0.00 0.65 0.00 -2.24 -1.26 -1.84 114.28 114.45 1req n THR 287 Ca -0.15 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.76 1req n THR 287 Cb 0.48 -0.94 0.30 0.00 -2.10 0.00 0.00 70.33 68.08 1req n THR 287 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1req n HIS 288 N -0.63 0.65 -2.61 4.78 1.44 -1.26 -3.87 115.22 113.72 1req n HIS 288 Ca 0.00 0.19 -0.41 0.00 -2.01 0.00 0.00 57.72 55.49 1req n HIS 288 Cb 0.00 -0.75 -0.03 0.00 0.12 0.00 0.00 29.99 29.33 1req n HIS 288 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1req s ASP 289 N -4.21 6.33 0.10 4.39 -1.08 -1.26 -4.85 116.67 116.09 1req s ASP 289 Ca 0.09 -1.01 -0.31 0.00 -0.52 0.00 0.00 52.55 50.80 1req s ASP 289 Cb 0.14 -2.54 -0.13 0.00 -1.46 0.00 0.00 42.92 38.92 1req s ASP 289 CO 0.65 -1.62 1.61 -0.61 0.52 0.00 0.00 175.17 175.72 1req h GLN 290 N 9.81 -0.73 0.00 4.34 4.15 -1.90 -1.25 115.11 129.53 1req h GLN 290 Ca -0.06 0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.35 1req h GLN 290 Cb 1.03 0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.88 1req h GLN 290 CO 1.32 -0.48 -0.28 0.74 -1.93 0.00 0.00 178.83 178.20 1req h PHE 291 N -0.75 0.00 0.01 3.99 0.04 -1.97 -2.50 116.94 115.75 1req h PHE 291 Ca -0.02 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.51 1req h PHE 291 Cb 0.69 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.84 1req h PHE 291 CO -0.22 0.28 -0.97 -0.07 -0.60 0.00 0.00 178.31 176.72 1req h LEU 292 N 0.00 0.57 -0.19 1.54 3.38 -1.96 -2.35 115.31 116.29 1req h LEU 292 Ca -0.00 -0.46 0.01 0.00 0.09 0.00 0.00 57.88 57.51 1req h LEU 292 Cb 1.18 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1req h LEU 292 CO 0.04 1.27 0.11 0.74 0.09 0.00 0.00 178.44 180.68 1req h THR 293 N 0.24 1.02 0.10 0.22 2.02 -1.15 -1.98 112.91 113.38 1req h THR 293 Ca -0.09 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.01 1req h THR 293 Cb 1.61 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 68.80 1req h THR 293 CO 0.17 0.04 -0.05 0.40 0.37 0.00 0.00 175.52 176.45 1req h ILE 294 N 0.22 0.97 -0.95 3.11 2.04 -1.43 -2.05 117.51 119.43 1req h ILE 294 Ca 0.07 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.68 1req h ILE 294 Cb -0.00 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 1req h ILE 294 CO -0.04 0.06 0.60 0.00 0.00 0.00 0.00 178.15 178.78 1req h ALA 295 N 0.65 1.21 -0.24 1.87 0.00 -1.42 -2.51 119.26 118.82 1req h ALA 295 Ca -0.01 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 1req h ALA 295 Cb 0.20 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1req h ALA 295 CO 0.02 0.64 -0.35 -0.09 0.00 0.00 0.00 179.25 179.47 1req h ARG 296 N 1.30 0.65 -0.42 0.00 2.43 -1.22 -0.30 114.38 116.82 1req h ARG 296 Ca 0.35 -0.39 -0.05 0.00 -0.81 0.00 0.00 59.98 59.08 1req h ARG 296 Cb -0.10 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1req h ARG 296 CO -0.07 1.00 0.07 -0.07 -1.51 0.00 0.00 179.97 179.39 1req h LEU 297 N 0.36 0.60 -0.20 3.80 3.38 -1.32 -1.00 115.31 120.93 1req h LEU 297 Ca 0.02 -0.10 -0.22 0.00 0.09 0.00 0.00 57.88 57.67 1req h LEU 297 Cb 0.93 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.53 1req h LEU 297 CO 0.08 0.62 -0.88 0.03 0.09 0.00 0.00 178.44 178.39 1req h ARG 298 N 0.62 0.53 -0.15 1.13 3.08 -1.38 -3.28 114.38 114.93 1req h ARG 298 Ca 0.14 -0.50 -0.17 0.00 0.07 0.00 0.00 59.98 59.52 1req h ARG 298 Cb 0.29 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 1req h ARG 298 CO 0.00 1.13 -0.60 0.00 -1.07 0.00 0.00 179.97 179.44 1req h ALA 299 N 0.70 0.67 0.03 0.04 0.00 -0.86 -1.94 119.26 117.91 1req h ALA 299 Ca -0.07 -0.54 0.03 0.00 0.00 0.00 0.00 54.91 54.33 1req h ALA 299 Cb 1.50 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.17 1req h ALA 299 CO 0.16 0.70 -0.23 1.25 0.00 0.00 0.00 179.25 181.13 1req h LEU 300 N 0.38 -0.67 -0.84 0.00 6.46 -1.25 -1.11 115.31 118.28 1req h LEU 300 Ca -0.00 0.09 -0.07 0.00 -0.12 0.00 0.00 57.88 57.78 1req h LEU 300 Cb 1.15 0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 41.33 1req h LEU 300 CO 0.11 -0.31 0.08 0.03 -0.62 0.00 0.00 178.44 177.74 1req h ARG 301 N -0.38 0.95 -0.36 1.25 3.08 -1.56 -0.36 114.38 117.00 1req h ARG 301 Ca 0.05 -0.24 0.01 0.00 0.07 0.00 0.00 59.98 59.87 1req h ARG 301 Cb 0.45 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 1req h ARG 301 CO -0.18 0.89 0.22 1.49 -1.07 0.00 0.00 179.97 181.31 1req h GLU 302 N 0.90 0.44 -0.21 0.04 4.81 -1.08 -1.69 114.58 117.79 1req h GLU 302 Ca 0.18 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.27 1req h GLU 302 Cb 0.41 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1req h GLU 302 CO 0.01 0.29 -0.34 0.00 -0.73 0.00 0.00 179.01 178.24 1req h ALA 303 N 1.15 0.32 -0.33 2.92 0.00 -0.87 -3.15 119.26 119.29 1req h ALA 303 Ca 0.14 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 1req h ALA 303 Cb -0.02 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1req h ALA 303 CO -0.05 0.37 -0.02 2.35 0.00 0.00 0.00 179.25 181.89 1req h TRP 304 N 0.27 0.55 0.00 0.00 -0.00 -1.05 -1.35 115.95 114.37 1req h TRP 304 Ca 0.02 -0.06 -0.08 0.00 -0.00 0.00 0.00 58.89 58.77 1req h TRP 304 Cb 0.92 -0.16 -0.01 0.00 -0.00 0.00 0.00 29.16 29.92 1req h TRP 304 CO 0.09 0.55 -0.38 0.00 -0.00 0.00 0.00 178.44 178.70 1req h ALA 305 N 1.48 1.33 -0.36 2.65 0.00 -1.32 -1.85 119.26 121.19 1req h ALA 305 Ca 0.11 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 1req h ALA 305 Cb 0.36 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1req h ALA 305 CO 0.01 0.47 -0.29 -0.09 0.00 0.00 0.00 179.25 179.35 1req h ARG 306 N 0.00 0.76 0.54 0.00 9.65 -1.23 -1.99 114.38 122.11 1req h ARG 306 Ca -0.00 -0.34 -0.02 0.00 -1.10 0.00 0.00 59.98 58.52 1req h ARG 306 Cb 0.69 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.24 1req h ARG 306 CO 0.05 0.96 -0.37 0.82 2.80 0.00 0.00 179.97 184.22 1req h ILE 307 N 0.65 0.24 -0.88 1.20 2.04 -0.64 -1.42 117.51 118.69 1req h ILE 307 Ca 0.08 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.12 1req h ILE 307 Cb 0.82 0.24 -0.16 0.00 -0.74 0.00 0.00 36.82 36.97 1req h ILE 307 CO 0.07 0.00 -0.16 1.23 0.00 0.00 0.00 178.15 179.29 1req h GLY 308 N -0.89 0.74 0.95 5.37 0.00 -1.39 -0.51 103.07 107.34 1req h GLY 308 Ca -0.06 0.25 0.01 0.00 0.00 0.00 0.00 47.33 47.53 1req h GLY 308 CO 0.04 -0.35 0.31 -2.09 0.00 0.00 0.00 176.54 174.45 1req h GLU 309 N 0.01 0.62 -0.11 4.80 4.81 -1.02 0.11 114.58 123.80 1req h GLU 309 Ca 0.44 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.50 1req h GLU 309 Cb 0.73 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1req h GLU 309 CO -0.88 0.41 -0.52 0.28 -0.73 0.00 0.00 179.01 177.57 1req h VAL 310 N 0.64 1.35 0.00 0.32 2.07 -0.27 -2.89 116.25 117.47 1req h VAL 310 Ca 0.19 -1.78 0.00 0.00 0.82 0.00 0.00 66.70 65.93 1req h VAL 310 Cb -0.03 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 1req h VAL 310 CO -0.06 0.53 0.00 0.49 0.02 0.00 0.00 177.57 178.55 1req n PHE 311 N -3.94 0.16 -1.36 1.57 3.72 -0.29 -4.93 117.46 112.38 1req n PHE 311 Ca -0.02 0.05 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1req n PHE 311 Cb 0.56 -0.58 0.00 0.00 -0.94 0.00 0.00 39.48 38.52 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 1.44 0.50 3.76 1.37 0.00 -0.12 -4.75 105.19 107.40 1req n GLY 312 Ca 0.07 -0.88 -0.38 0.00 0.00 0.00 0.00 46.02 44.83 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 -2.00 2.78 0.14 1.61 1.01 -0.36 -4.78 120.40 118.80 1req s VAL 313 Ca 0.00 0.60 -0.35 0.00 0.00 0.00 0.00 61.98 62.24 1req s VAL 313 Cb 0.00 -3.32 -0.16 0.00 0.00 0.00 0.00 36.38 32.91 1req s VAL 313 CO 0.00 0.01 1.33 0.47 0.00 0.00 0.00 175.10 176.91 1req n ASP 314 N -0.50 1.89 -0.11 3.32 9.92 -1.26 -4.73 116.55 125.08 1req n ASP 314 Ca 0.07 1.12 0.21 0.00 -0.53 0.00 0.00 54.79 55.67 1req n ASP 314 Cb 0.46 -1.26 0.64 0.00 -0.64 0.00 0.00 41.12 40.33 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 4.40 0.13 0.00 -1.24 4.11 -1.96 -1.28 114.58 118.74 1req h GLU 315 Ca -0.46 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1req h GLU 315 Cb 1.32 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1req h GLU 315 CO 0.77 0.09 -0.15 -0.40 0.07 0.00 0.00 179.01 179.39 1req n ASP 316 N -4.39 0.78 -1.54 3.06 5.75 -1.26 -3.42 116.55 115.54 1req n ASP 316 Ca 0.14 0.46 0.08 0.00 -0.01 0.00 0.00 54.79 55.47 1req n ASP 316 Cb 0.70 -0.56 0.35 0.00 -1.03 0.00 0.00 41.12 40.58 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 -2.22 3.98 0.00 0.11 5.02 -0.48 -4.64 118.16 119.93 1req n LYS 317 Ca 0.05 -2.94 0.15 0.00 -2.02 0.00 0.00 58.31 53.55 1req n LYS 317 Cb 0.43 -1.98 0.72 0.00 -0.02 0.00 0.00 35.03 34.18 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 0.66 1.23 -2.51 1.97 1.74 -1.22 -4.87 116.66 113.66 1req n ARG 318 Ca 0.25 -0.44 -0.42 0.00 -0.77 0.00 0.00 57.85 56.47 1req n ARG 318 Cb 0.98 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.90 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 -2.07 2.29 0.38 -0.13 0.00 -1.26 -3.39 107.32 103.13 1req s GLY 319 Ca 0.41 0.63 -0.25 0.00 0.00 0.00 0.00 44.72 45.50 1req s GLY 319 CO 0.37 2.08 1.11 0.00 0.00 0.00 0.00 173.10 176.66 1req s ALA 320 N 1.80 3.17 -0.24 3.20 0.00 -1.26 -4.98 121.76 123.45 1req s ALA 320 Ca 0.55 0.85 -0.04 0.00 0.00 0.00 0.00 51.96 53.32 1req s ALA 320 Cb -0.24 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1req s ALA 320 CO 0.24 -0.34 -0.03 1.03 0.00 0.00 0.00 175.76 176.65 1req s ARG 321 N -2.23 3.17 -0.11 0.00 0.52 -1.26 -4.63 118.95 114.41 1req s ARG 321 Ca 0.55 -0.76 0.01 0.00 -0.52 0.00 0.00 55.73 55.01 1req s ARG 321 Cb -0.27 -3.04 -0.01 0.00 0.52 0.00 0.00 34.95 32.14 1req s ARG 321 CO 0.35 -0.29 -0.16 -0.65 0.02 0.00 0.00 175.30 174.57 1req s GLN 322 N 1.43 3.21 -0.46 3.54 -0.21 -1.26 -1.08 119.66 124.83 1req s GLN 322 Ca 0.04 -0.73 -0.10 0.00 0.02 0.00 0.00 55.36 54.59 1req s GLN 322 Cb -0.15 -2.53 0.11 0.00 1.00 0.00 0.00 33.01 31.43 1req s GLN 322 CO -0.03 0.25 0.34 -0.80 -2.12 0.00 0.00 175.29 172.93 1req s ASN 323 N 0.23 5.76 0.09 5.90 0.01 0.16 0.01 114.94 127.11 1req s ASN 323 Ca -0.10 -1.76 -0.23 0.00 -0.71 0.00 0.00 52.86 50.06 1req s ASN 323 Cb -0.16 -2.03 -0.07 0.00 0.41 0.00 0.00 41.25 39.40 1req s ASN 323 CO 0.06 -0.67 0.69 0.00 -1.51 0.00 0.00 177.10 175.67 1req s ALA 324 N 1.42 3.48 -0.03 0.60 0.00 -0.73 -1.81 121.76 124.69 1req s ALA 324 Ca 0.05 0.20 0.06 0.00 0.00 0.00 0.00 51.96 52.27 1req s ALA 324 Cb -0.26 -2.84 -0.01 0.00 0.00 0.00 0.00 23.12 20.02 1req s ALA 324 CO 0.01 0.27 -0.21 -1.50 0.00 0.00 0.00 175.76 174.33 1req s ILE 325 N -0.83 1.66 0.96 0.00 2.07 -0.45 -0.64 121.20 123.98 1req s ILE 325 Ca 0.33 -0.88 -0.12 0.00 -1.41 0.00 0.00 60.65 58.58 1req s ILE 325 Cb -0.21 -1.40 0.17 0.00 0.13 0.00 0.00 42.46 41.15 1req s ILE 325 CO 0.22 0.47 1.09 0.42 -1.91 0.00 0.00 174.94 175.23 1req s THR 326 N -0.29 2.41 -0.10 4.00 -4.23 -0.10 -1.41 115.64 115.92 1req s THR 326 Ca 0.03 0.13 -0.29 0.00 -1.18 0.00 0.00 61.69 60.38 1req s THR 326 Cb -0.10 -2.48 -0.04 0.00 1.34 0.00 0.00 72.50 71.23 1req s THR 326 CO 0.01 -0.18 1.45 -0.55 -0.54 0.00 0.00 174.62 174.82 1req s SER 327 N -3.15 6.81 0.08 3.99 0.15 -0.77 -4.66 113.70 116.15 1req s SER 327 Ca 0.65 1.97 -0.05 0.00 0.70 0.00 0.00 55.95 59.23 1req s SER 327 Cb -0.20 -2.54 -0.26 0.00 -1.71 0.00 0.00 66.02 61.31 1req s SER 327 CO 0.59 -0.83 1.16 -0.25 1.20 0.00 0.00 173.24 175.10 1req h TRP 328 N 8.80 0.52 -0.26 3.44 7.01 -1.93 -3.26 115.95 130.28 1req h TRP 328 Ca -0.33 -0.37 -0.02 0.00 2.11 0.00 0.00 58.89 60.29 1req h TRP 328 Cb 1.14 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 28.16 1req h TRP 328 CO 0.84 1.27 0.09 -0.09 -2.79 0.00 0.00 178.44 177.76 1req h ARG 329 N 0.09 0.35 -0.00 2.65 2.43 -1.91 -2.31 114.38 115.68 1req h ARG 329 Ca -0.13 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1req h ARG 329 Cb 1.93 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 31.41 1req h ARG 329 CO 0.20 0.31 -0.05 0.39 -1.51 0.00 0.00 179.97 179.31 1req n GLU 330 N -4.42 0.92 -2.74 0.20 1.02 -1.23 -1.47 120.64 112.91 1req n GLU 330 Ca 0.01 -0.26 -0.38 0.00 -0.02 0.00 0.00 57.16 56.51 1req n GLU 330 Cb 0.13 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.00 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 -2.27 4.40 0.09 -4.62 1.43 -0.87 -4.97 118.68 111.87 1req s LEU 331 Ca 0.36 1.89 0.08 0.00 -1.03 0.00 0.00 54.13 55.44 1req s LEU 331 Cb 0.21 -3.93 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 1req s LEU 331 CO 0.42 -0.06 -0.19 0.42 0.23 0.00 0.00 176.35 177.18 1req s THR 332 N -1.52 2.77 -0.01 5.49 -4.23 -1.26 -4.70 115.64 112.18 1req s THR 332 Ca 0.49 -1.40 -0.21 0.00 -1.18 0.00 0.00 61.69 59.39 1req s THR 332 Cb -0.21 -2.22 -0.25 0.00 1.34 0.00 0.00 72.50 71.15 1req s THR 332 CO 0.26 0.19 1.04 -0.09 -0.54 0.00 0.00 174.62 175.49 1req h ARG 333 N 4.07 0.37 -6.64 3.99 2.43 -1.94 -3.43 114.38 113.22 1req h ARG 333 Ca -0.49 -0.44 -0.51 0.00 -0.81 0.00 0.00 59.98 57.73 1req h ARG 333 Cb 1.16 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.84 1req h ARG 333 CO 0.46 1.12 0.42 -1.21 -1.51 0.00 0.00 179.97 179.25 1req s GLU 334 N -3.01 4.67 -0.81 0.20 8.01 -1.26 -3.97 118.70 122.52 1req s GLU 334 Ca -0.13 1.59 -0.02 0.00 0.01 0.00 0.00 54.97 56.41 1req s GLU 334 Cb 0.03 -3.32 -0.00 0.00 -4.31 0.00 0.00 34.13 26.53 1req s GLU 334 CO 0.82 0.19 0.69 -3.47 0.01 0.00 0.00 175.26 173.49 1req n ASP 335 N 2.41 -6.66 0.17 -0.19 -0.08 -1.26 -4.86 116.55 106.07 1req n ASP 335 Ca 0.02 -0.45 0.03 0.00 -1.51 0.00 0.00 54.79 52.88 1req n ASP 335 Cb 0.47 -4.05 0.28 0.00 2.34 0.00 0.00 41.12 40.17 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 -0.02 0.00 -0.08 -0.67 0.13 -1.74 -2.55 132.00 127.07 1req h PRO 336 Ca -0.27 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.88 1req h PRO 336 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1req h PRO 336 CO 0.34 0.46 0.27 1.88 -0.23 0.00 0.00 178.00 180.72 1req h TYR 337 N 0.00 0.00 0.00 1.56 -1.99 -1.87 -0.76 116.97 113.91 1req h TYR 337 Ca -0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.70 1req h TYR 337 Cb 0.94 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.66 1req h TYR 337 CO 0.00 0.00 -0.10 0.28 -0.00 0.00 0.00 178.16 178.34 1req h VAL 338 N 0.00 0.38 0.00 -2.88 2.07 -1.80 -2.87 116.25 111.14 1req h VAL 338 Ca 0.04 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 1req h VAL 338 Cb 0.57 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1req h VAL 338 CO -0.00 0.10 -0.05 0.78 0.02 0.00 0.00 177.57 178.42 1req h ASN 339 N 0.00 0.00 -0.66 0.57 2.35 -1.34 -1.02 115.58 115.48 1req h ASN 339 Ca -0.00 0.00 0.13 0.00 -0.55 0.00 0.00 56.30 55.88 1req h ASN 339 Cb 0.41 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.68 1req h ASN 339 CO 0.01 0.05 0.16 0.40 -1.65 0.00 0.00 177.43 176.40 1req h ILE 340 N 0.00 0.59 -0.30 2.81 2.04 -1.67 0.16 117.51 121.14 1req h ILE 340 Ca -0.00 -0.09 -0.13 0.00 1.00 0.00 0.00 64.86 65.64 1req h ILE 340 Cb 0.13 0.29 -0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1req h ILE 340 CO 0.01 0.05 -0.31 -0.07 0.00 0.00 0.00 178.15 177.83 1req h LEU 341 N 0.28 0.79 -0.59 1.44 3.38 -1.36 -0.95 115.31 118.30 1req h LEU 341 Ca 0.36 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1req h LEU 341 Cb 0.56 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1req h LEU 341 CO -0.45 1.10 0.24 0.03 0.09 0.00 0.00 178.44 179.45 1req h ARG 342 N 0.48 0.88 -0.74 1.13 3.08 -1.22 -1.49 114.38 116.50 1req h ARG 342 Ca 0.05 -0.16 0.01 0.00 0.07 0.00 0.00 59.98 59.95 1req h ARG 342 Cb 0.89 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.76 1req h ARG 342 CO 0.08 0.75 0.49 0.78 -1.07 0.00 0.00 179.97 181.00 1req h GLY 343 N 0.81 1.05 0.74 0.04 0.00 -0.64 -2.03 103.07 103.04 1req h GLY 343 Ca 0.20 -0.38 0.01 0.00 0.00 0.00 0.00 47.33 47.15 1req h GLY 343 CO -0.02 0.37 -0.16 1.76 0.00 0.00 0.00 176.54 178.49 1req h SER 344 N 0.99 -0.45 0.46 0.19 0.02 -0.59 -0.25 113.55 113.93 1req h SER 344 Ca 0.28 0.05 -0.16 0.00 -0.84 0.00 0.00 61.79 61.12 1req h SER 344 Cb -0.09 0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1req h SER 344 CO -0.07 -0.24 -0.68 -0.29 -1.14 0.00 0.00 176.83 174.42 1req h ILE 345 N -0.33 1.43 -0.24 3.27 2.10 -1.25 -2.40 117.51 120.08 1req h ILE 345 Ca 0.02 -2.17 -0.18 0.00 1.08 0.00 0.00 64.86 63.60 1req h ILE 345 Cb 0.34 2.14 -0.00 0.00 -1.09 0.00 0.00 36.82 38.21 1req h ILE 345 CO -0.08 0.64 -0.58 0.00 -1.08 0.00 0.00 178.15 177.05 1req h ALA 346 N 1.17 0.52 -0.63 0.18 0.00 -1.29 -1.37 119.26 117.83 1req h ALA 346 Ca -0.01 -0.53 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 1req h ALA 346 Cb 1.21 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1req h ALA 346 CO 0.10 0.69 0.28 1.15 0.00 0.00 0.00 179.25 181.47 1req h THR 347 N 0.58 1.23 0.26 0.00 2.02 -1.01 -0.89 112.91 115.09 1req h THR 347 Ca 0.00 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 66.52 1req h THR 347 Cb 1.17 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.05 1req h THR 347 CO 0.12 0.27 -0.24 0.15 0.37 0.00 0.00 175.52 176.19 1req h PHE 348 N 0.88 -0.62 -0.55 3.16 3.04 -1.39 -2.09 116.94 119.38 1req h PHE 348 Ca 0.22 0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.12 1req h PHE 348 Cb 0.15 0.24 -0.03 0.00 2.56 0.00 0.00 35.95 38.88 1req h PHE 348 CO 0.01 -0.35 0.16 0.77 -2.02 0.00 0.00 178.31 176.88 1req h SER 349 N -0.52 0.76 -0.79 0.41 0.02 -0.97 -1.47 113.55 110.98 1req h SER 349 Ca -0.01 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.80 1req h SER 349 Cb 0.47 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 1req h SER 349 CO -0.04 0.73 0.45 0.00 -1.14 0.00 0.00 176.83 176.83 1req h ALA 350 N 1.38 1.28 0.00 3.77 0.00 -1.07 0.69 119.26 125.31 1req h ALA 350 Ca 0.18 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1req h ALA 350 Cb 0.25 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1req h ALA 350 CO -0.01 0.59 -0.00 1.03 0.00 0.00 0.00 179.25 180.86 1req h SER 351 N 1.12 -0.00 -0.11 0.00 0.87 -1.10 -1.55 113.55 112.78 1req h SER 351 Ca 0.29 -0.30 -0.04 0.00 -1.23 0.00 0.00 61.79 60.51 1req h SER 351 Cb 0.01 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 1req h SER 351 CO -0.05 0.30 -0.04 0.58 -0.53 0.00 0.00 176.83 177.09 1req h VAL 352 N -0.30 1.17 0.00 2.23 2.07 -1.10 -1.62 116.25 118.70 1req h VAL 352 Ca -0.00 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1req h VAL 352 Cb 0.30 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1req h VAL 352 CO 0.00 0.23 0.00 0.61 0.02 0.00 0.00 177.57 178.43 1req n GLY 353 N -0.95 -1.05 1.27 2.17 0.00 0.22 -4.67 105.19 102.18 1req n GLY 353 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 0.90 3.77 -0.02 0.00 -0.61 -4.14 105.19 104.92 1req n GLY 354 Ca 0.03 -0.58 -0.40 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 -2.87 3.39 0.24 4.61 0.00 -0.72 -4.80 121.76 121.61 1req s ALA 355 Ca 0.00 1.05 0.04 0.00 0.00 0.00 0.00 51.96 53.06 1req s ALA 355 Cb 0.00 -3.40 0.26 0.00 0.00 0.00 0.00 23.12 19.98 1req s ALA 355 CO 0.00 -0.42 1.57 0.93 0.00 0.00 0.00 175.76 177.84 1req h GLU 356 N 3.40 0.25 -4.43 0.00 3.07 -0.77 -3.45 114.58 112.65 1req h GLU 356 Ca -0.48 -0.16 -0.20 0.00 -0.50 0.00 0.00 59.36 58.01 1req h GLU 356 Cb 1.22 0.02 -0.17 0.00 -0.84 0.00 0.00 28.75 28.98 1req h GLU 356 CO 0.65 0.76 -0.70 -1.54 -1.40 0.00 0.00 179.01 176.78 1req s SER 357 N -6.90 0.78 -0.05 1.42 1.04 -1.21 -2.06 113.70 106.73 1req s SER 357 Ca -0.04 -0.81 -0.00 0.00 0.48 0.00 0.00 55.95 55.58 1req s SER 357 Cb 0.12 0.10 0.03 0.00 0.10 0.00 0.00 66.02 66.37 1req s SER 357 CO 0.80 -0.40 0.00 -0.63 0.98 0.00 0.00 173.24 173.99 1req s ILE 358 N -2.77 0.26 -0.26 -1.02 1.01 -0.84 -1.78 121.20 115.80 1req s ILE 358 Ca 0.01 0.11 -0.04 0.00 0.00 0.00 0.00 60.65 60.72 1req s ILE 358 Cb -0.00 -0.38 0.01 0.00 0.01 0.00 0.00 42.46 42.09 1req s ILE 358 CO -0.04 0.20 -0.00 -0.89 0.00 0.00 0.00 174.94 174.20 1req s THR 359 N 1.45 3.44 -0.26 2.92 2.01 0.19 -2.43 115.64 122.96 1req s THR 359 Ca -0.03 -0.72 -0.15 0.00 0.31 0.00 0.00 61.69 61.10 1req s THR 359 Cb -0.13 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 69.64 1req s THR 359 CO -0.03 0.23 0.38 -0.89 -0.69 0.00 0.00 174.62 173.62 1req s THR 360 N 1.44 5.18 0.50 -0.82 2.01 -1.26 -0.92 115.64 121.77 1req s THR 360 Ca 0.03 0.59 -0.22 0.00 0.31 0.00 0.00 61.69 62.40 1req s THR 360 Cb -0.16 -3.70 -0.06 0.00 0.01 0.00 0.00 72.50 68.59 1req s THR 360 CO -0.02 0.17 1.22 -0.76 -0.69 0.00 0.00 174.62 174.54 1req s LEU 361 N 1.97 3.91 0.63 4.42 1.43 -1.26 -4.81 118.68 124.97 1req s LEU 361 Ca 0.15 2.42 -0.18 0.00 -1.03 0.00 0.00 54.13 55.49 1req s LEU 361 Cb -0.16 -4.32 -0.02 0.00 0.03 0.00 0.00 46.19 41.73 1req s LEU 361 CO 0.10 -1.19 1.27 -2.84 0.23 0.00 0.00 176.35 173.92 1req s PRO 362 N -2.87 2.67 0.44 1.29 0.02 -1.26 -4.83 135.00 130.45 1req s PRO 362 Ca 0.68 1.99 0.24 0.00 0.02 0.00 0.00 61.00 63.93 1req s PRO 362 Cb -0.31 -1.87 0.83 0.00 0.02 0.00 0.00 34.50 33.17 1req s PRO 362 CO 0.37 -1.49 1.78 0.27 -0.33 0.00 0.00 177.00 177.61 1req h PHE 363 N 0.63 0.00 0.00 6.54 -0.00 -1.88 -2.36 116.94 119.87 1req h PHE 363 Ca -0.51 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.46 1req h PHE 363 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.28 1req h PHE 363 CO 0.43 0.21 0.00 0.25 -0.00 0.00 0.00 178.31 179.20 1req n THR 364 N -3.31 0.00 0.58 0.88 -2.24 -1.26 -4.57 114.28 104.36 1req n THR 364 Ca 0.01 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.90 1req n THR 364 Cb 0.46 -0.33 0.44 0.00 -2.10 0.00 0.00 70.33 68.80 1req n THR 364 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1req n GLN 365 N -0.68 0.11 0.01 -0.78 -0.06 -0.89 -1.81 117.38 113.28 1req n GLN 365 Ca 0.06 0.26 0.12 0.00 -2.00 0.00 0.00 57.00 55.43 1req n GLN 365 Cb 0.03 -1.68 0.14 0.00 -4.06 0.00 0.00 30.24 24.67 1req n GLN 365 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1req n ALA 366 N -1.64 3.66 -0.11 1.69 0.00 -1.26 -4.41 120.51 118.44 1req n ALA 366 Ca 0.04 -0.39 -0.19 0.00 0.00 0.00 0.00 53.44 52.90 1req n ALA 366 Cb 0.27 -1.04 -0.09 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.65 2.30 0.00 0.00 4.77 -0.82 -4.79 117.00 116.81 1req n LEU 367 Ca 0.04 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1req n LEU 367 Cb 0.36 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1req n LEU 367 CO 0.37 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.71 1req n GLY 368 N 2.07 -1.36 3.82 -0.72 0.00 -0.75 -4.70 105.19 103.54 1req n GLY 368 Ca -0.40 -1.16 -0.37 0.00 0.00 0.00 0.00 46.02 44.08 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 4.42 0.24 0.99 1.43 0.13 -4.23 118.68 121.66 1req s LEU 369 Ca 0.00 1.26 -0.30 0.00 -1.03 0.00 0.00 54.13 54.06 1req s LEU 369 Cb 0.00 -3.23 -0.15 0.00 0.03 0.00 0.00 46.19 42.85 1req s LEU 369 CO 0.00 0.15 1.11 -2.65 0.23 0.00 0.00 176.35 175.19 1req n PRO 370 N 1.13 1.36 0.13 1.29 -0.02 -1.26 0.12 135.00 137.74 1req n PRO 370 Ca -0.06 0.48 0.12 0.00 -2.02 0.00 0.00 63.50 62.02 1req n PRO 370 Cb 0.51 -1.93 0.21 0.00 -0.02 0.00 0.00 33.50 32.27 1req n PRO 370 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1req h GLU 371 N 2.74 0.00 0.00 -0.52 4.81 -1.91 -3.43 114.58 116.28 1req h GLU 371 Ca -0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 1req h GLU 371 Cb 1.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.71 1req h GLU 371 CO 0.66 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.54 1req n ASP 372 N -2.54 0.00 0.20 1.04 5.68 -1.26 -5.03 116.55 114.64 1req n ASP 372 Ca 0.04 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.43 1req n ASP 372 Cb 0.48 0.00 0.13 0.00 -1.14 0.00 0.00 41.12 40.59 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 -0.53 -1.12 3.58 -2.01 -3.40 116.42 112.94 1req h ASP 373 Ca 0.00 0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.50 1req h ASP 373 Cb 0.00 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 40.98 1req h ASP 373 CO 0.00 0.06 -0.36 0.15 -2.88 0.00 0.00 179.24 176.20 1req h PHE 374 N 0.00 -1.15 -0.49 0.28 3.57 -1.99 0.39 116.94 117.55 1req h PHE 374 Ca -0.00 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 1req h PHE 374 Cb 1.05 0.57 -0.02 0.00 2.79 0.00 0.00 35.95 40.33 1req h PHE 374 CO 0.00 -0.25 0.22 -1.35 -2.23 0.00 0.00 178.31 174.70 1req h PRO 375 N -0.06 0.69 -0.45 6.41 0.11 -2.00 -1.99 132.00 134.71 1req h PRO 375 Ca 0.09 -0.09 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 1req h PRO 375 Cb 0.28 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 1req h PRO 375 CO -0.53 0.55 -0.12 -0.07 -0.21 0.00 0.00 178.00 177.62 1req h LEU 376 N 0.69 0.89 -1.24 2.35 3.38 -1.23 -2.31 115.31 117.84 1req h LEU 376 Ca 0.17 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1req h LEU 376 Cb 0.10 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1req h LEU 376 CO -0.02 1.05 0.25 -0.09 0.09 0.00 0.00 178.44 179.72 1req h ARG 377 N 0.72 0.77 -0.11 1.13 2.43 0.11 -1.50 114.38 117.92 1req h ARG 377 Ca 0.11 -0.10 -0.18 0.00 -0.81 0.00 0.00 59.98 59.00 1req h ARG 377 Cb 0.67 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1req h ARG 377 CO 0.05 0.61 -0.69 0.82 -1.51 0.00 0.00 179.97 179.25 1req h ILE 378 N 0.77 1.35 -0.16 1.20 1.08 -1.26 0.29 117.51 120.79 1req h ILE 378 Ca 0.19 -2.03 -0.02 0.00 -0.39 0.00 0.00 64.86 62.60 1req h ILE 378 Cb 0.11 2.01 -0.01 0.00 -3.07 0.00 0.00 36.82 35.86 1req h ILE 378 CO -0.02 0.62 0.02 0.00 -0.69 0.00 0.00 178.15 178.07 1req h ALA 379 N 0.90 0.21 -0.11 1.87 0.00 -1.02 -1.70 119.26 119.42 1req h ALA 379 Ca -0.02 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 1req h ALA 379 Cb 1.26 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1req h ALA 379 CO 0.12 -0.11 -0.54 0.07 0.00 0.00 0.00 179.25 178.79 1req h ARG 380 N 0.04 0.31 0.00 0.00 0.11 -1.21 -3.07 114.38 110.56 1req h ARG 380 Ca 0.05 -0.19 0.00 0.00 0.10 0.00 0.00 59.98 59.93 1req h ARG 380 Cb 0.33 0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.43 1req h ARG 380 CO 0.00 0.78 0.00 -0.91 0.10 0.00 0.00 179.97 179.94 1req h ASN 381 N 0.24 0.00 0.36 0.08 2.35 -0.85 -2.22 115.58 115.54 1req h ASN 381 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1req h ASN 381 Cb 1.03 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.37 1req h ASN 381 CO 0.09 0.00 -0.42 0.74 -1.65 0.00 0.00 177.43 176.19 1req h THR 382 N 0.00 0.16 -0.39 2.81 2.02 -1.20 0.29 112.91 116.60 1req h THR 382 Ca 0.00 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.03 1req h THR 382 Cb 0.52 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 1req h THR 382 CO 0.00 0.00 -0.36 1.23 0.37 0.00 0.00 175.52 176.76 1req h GLY 383 N -0.81 1.01 1.00 2.16 0.00 -1.62 -1.83 103.07 102.98 1req h GLY 383 Ca -0.03 -1.02 -0.03 0.00 0.00 0.00 0.00 47.33 46.26 1req h GLY 383 CO -0.10 0.92 0.29 -2.22 0.00 0.00 0.00 176.54 175.43 1req h ILE 384 N 0.75 1.22 -0.38 2.60 2.04 -1.20 -0.11 117.51 122.44 1req h ILE 384 Ca 0.07 -0.65 -0.06 0.00 1.00 0.00 0.00 64.86 65.21 1req h ILE 384 Cb 0.95 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1req h ILE 384 CO 0.09 0.26 0.01 0.58 0.00 0.00 0.00 178.15 179.09 1req h VAL 385 N 0.87 1.26 -0.63 1.67 2.07 -0.42 -0.78 116.25 120.28 1req h VAL 385 Ca 0.21 -0.98 0.07 0.00 0.82 0.00 0.00 66.70 66.83 1req h VAL 385 Cb 0.15 1.14 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 1req h VAL 385 CO -0.02 0.33 0.31 -0.07 0.02 0.00 0.00 177.57 178.13 1req h LEU 386 N 0.49 0.41 0.04 2.57 3.38 -0.98 0.32 115.31 121.54 1req h LEU 386 Ca 0.11 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1req h LEU 386 Cb 0.45 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1req h LEU 386 CO 0.02 0.26 -0.02 0.00 0.09 0.00 0.00 178.44 178.78 1req h ALA 387 N 1.37 -0.05 0.00 1.53 0.00 -0.87 -2.54 119.26 118.69 1req h ALA 387 Ca 0.30 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1req h ALA 387 Cb 0.27 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1req h ALA 387 CO -0.23 -0.33 -1.39 0.39 0.00 0.00 0.00 179.25 177.69 1req n GLU 388 N -4.92 0.62 -0.05 0.00 1.02 -0.31 -2.46 120.64 114.53 1req n GLU 388 Ca -0.08 0.16 -0.07 0.00 -0.02 0.00 0.00 57.16 57.15 1req n GLU 388 Cb 0.22 -1.78 -0.05 0.00 -0.02 0.00 0.00 31.44 29.80 1req n GLU 388 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1req n GLU 389 N -2.79 0.82 0.17 3.49 1.02 0.04 -4.58 120.64 118.81 1req n GLU 389 Ca -0.08 0.05 0.06 0.00 -0.02 0.00 0.00 57.16 57.17 1req n GLU 389 Cb 0.76 -1.22 0.10 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 0.54 -5.75 2.62 2.07 -1.43 -3.49 116.25 110.80 1req h VAL 390 Ca -0.24 -1.72 -0.43 0.00 0.82 0.00 0.00 66.70 65.12 1req h VAL 390 Cb 1.41 2.24 0.01 0.00 -1.52 0.00 0.00 31.29 33.43 1req h VAL 390 CO -0.03 0.30 -0.68 0.59 0.02 0.00 0.00 177.57 177.77 1req n ASN 391 N -3.19 -5.22 0.11 0.57 4.13 -0.98 -4.86 115.26 105.83 1req n ASN 391 Ca 0.03 -0.58 0.13 0.00 1.68 0.00 0.00 54.58 55.83 1req n ASN 391 Cb 0.64 -4.18 0.29 0.00 -1.54 0.00 0.00 39.78 34.99 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 -1.91 0.00 -0.21 2.41 3.07 -1.69 -3.18 117.51 115.99 1req h ILE 392 Ca -0.55 -0.59 0.00 0.00 1.55 0.00 0.00 64.86 65.28 1req h ILE 392 Cb 1.36 1.45 0.00 0.00 -0.27 0.00 0.00 36.82 39.36 1req h ILE 392 CO 0.61 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 178.32 1req n GLY 393 N 1.28 0.35 0.12 0.16 0.00 -1.26 -4.27 105.19 101.57 1req n GLY 393 Ca 0.04 -0.40 -0.03 0.00 0.00 0.00 0.00 46.02 45.63 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 2.11 0.03 -5.77 1.61 3.08 -1.79 -3.43 114.38 110.22 1req h ARG 394 Ca 0.00 -0.02 -0.66 0.00 0.07 0.00 0.00 59.98 59.36 1req h ARG 394 Cb 0.47 0.01 -0.18 0.00 0.08 0.00 0.00 29.97 30.34 1req h ARG 394 CO 0.00 0.74 -0.65 0.08 -1.07 0.00 0.00 179.97 179.07 1req s VAL 395 N -3.37 4.05 0.05 2.04 1.01 -1.26 -4.25 120.40 118.66 1req s VAL 395 Ca -0.01 -0.33 -0.30 0.00 0.00 0.00 0.00 61.98 61.34 1req s VAL 395 Cb 0.12 -2.72 -0.05 0.00 0.00 0.00 0.00 36.38 33.72 1req s VAL 395 CO 0.78 0.56 1.22 0.20 0.00 0.00 0.00 175.10 177.86 1req s ASN 396 N -0.42 7.05 -1.07 3.32 0.01 -1.26 -4.33 114.94 118.24 1req s ASN 396 Ca 0.07 2.01 -0.20 0.00 -0.71 0.00 0.00 52.86 54.02 1req s ASN 396 Cb -0.12 -2.58 0.02 0.00 0.41 0.00 0.00 41.25 38.98 1req s ASN 396 CO 0.02 -0.50 0.70 -0.67 -1.51 0.00 0.00 177.10 175.14 1req n ASP 397 N 4.17 -4.93 0.34 -1.22 2.03 -1.26 -4.88 116.55 110.79 1req n ASP 397 Ca 0.09 -1.06 0.21 0.00 0.52 0.00 0.00 54.79 54.55 1req n ASP 397 Cb 0.46 -2.45 1.10 0.00 -0.72 0.00 0.00 41.12 39.51 1req n ASP 397 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1req h PRO 398 N -1.66 0.00 0.00 -0.67 0.13 -1.83 -0.65 132.00 127.31 1req h PRO 398 Ca -0.64 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 1req h PRO 398 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 1req h PRO 398 CO 0.46 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.23 1req h ALA 399 N 1.80 1.00 -2.15 -0.56 0.00 -1.90 -3.47 119.26 113.98 1req h ALA 399 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.32 1req h ALA 399 Cb 0.20 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.02 1req h ALA 399 CO -0.00 0.00 1.09 0.41 0.00 0.00 0.00 179.25 180.75 1req n GLY 400 N 1.05 1.51 0.00 0.00 0.00 -0.25 -0.66 105.19 106.83 1req n GLY 400 Ca 0.05 0.82 0.00 0.00 0.00 0.00 0.00 46.02 46.89 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 4.29 2.72 3.66 -0.02 0.00 -1.26 -5.04 105.19 109.55 1req n GLY 401 Ca 0.21 -0.50 -0.65 0.00 0.00 0.00 0.00 46.02 45.09 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 0.38 0.81 0.20 1.61 2.88 0.17 -4.88 113.62 114.78 1req n SER 402 Ca 0.00 1.18 -0.16 0.00 -1.33 0.00 0.00 58.87 58.56 1req n SER 402 Cb 0.00 -0.90 -0.08 0.00 -0.75 0.00 0.00 64.21 62.48 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 4.34 -1.15 -0.25 0.66 0.05 -1.88 -0.08 116.97 118.66 1req h TYR 403 Ca -0.46 0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.39 1req h TYR 403 Cb 1.39 0.47 -0.07 0.00 1.01 0.00 0.00 36.73 39.52 1req h TYR 403 CO 0.62 -0.55 -0.31 -0.92 -1.05 0.00 0.00 178.16 175.96 1req h TYR 404 N -0.77 -0.84 -0.65 4.88 3.20 -1.89 -1.10 116.97 119.80 1req h TYR 404 Ca -0.01 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 1req h TYR 404 Cb 0.72 0.41 -0.03 0.00 1.54 0.00 0.00 36.73 39.37 1req h TYR 404 CO -0.28 -0.38 0.16 0.28 -1.64 0.00 0.00 178.16 176.31 1req h VAL 405 N -0.32 1.25 0.01 1.81 2.07 -1.76 -0.90 116.25 118.41 1req h VAL 405 Ca 0.13 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 1req h VAL 405 Cb 0.52 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1req h VAL 405 CO -0.42 0.35 -0.00 -0.33 0.02 0.00 0.00 177.57 177.18 1req h GLU 406 N 0.98 -0.01 -0.27 1.57 4.39 -1.04 0.98 114.58 121.18 1req h GLU 406 Ca 0.21 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.94 1req h GLU 406 Cb 0.34 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.96 1req h GLU 406 CO -0.00 0.24 0.07 1.03 -1.16 0.00 0.00 179.01 179.19 1req h SER 407 N -0.25 0.05 -0.53 1.42 0.87 -1.02 -2.09 113.55 112.00 1req h SER 407 Ca -0.00 0.04 -0.08 0.00 -1.23 0.00 0.00 61.79 60.51 1req h SER 407 Cb 0.25 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 1req h SER 407 CO 0.00 0.06 0.03 0.25 -0.53 0.00 0.00 176.83 176.64 1req h LEU 408 N 0.18 0.92 0.16 2.23 5.85 -1.11 -0.30 115.31 123.25 1req h LEU 408 Ca 0.12 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1req h LEU 408 Cb 0.11 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.90 1req h LEU 408 CO -0.15 0.96 -0.08 0.74 -0.34 0.00 0.00 178.44 179.58 1req h THR 409 N 0.89 0.85 -0.97 1.05 2.02 -0.55 -0.99 112.91 115.21 1req h THR 409 Ca 0.17 -0.04 0.02 0.00 0.77 0.00 0.00 66.41 67.33 1req h THR 409 Cb 0.48 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.72 1req h THR 409 CO 0.02 0.01 0.64 -0.09 0.37 0.00 0.00 175.52 176.47 1req h ARG 410 N -0.24 1.23 -0.69 6.66 1.12 -1.09 -0.81 114.38 120.57 1req h ARG 410 Ca -0.02 -0.07 -0.03 0.00 -1.11 0.00 0.00 59.98 58.75 1req h ARG 410 Cb 0.19 -0.28 -0.03 0.00 -0.01 0.00 0.00 29.97 29.84 1req h ARG 410 CO 0.04 0.82 0.32 0.77 -3.11 0.00 0.00 179.97 178.80 1req h SER 411 N 1.27 0.91 -0.01 -3.80 0.02 -0.84 -0.92 113.55 110.18 1req h SER 411 Ca 0.37 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1req h SER 411 Cb -0.08 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.22 1req h SER 411 CO -0.09 0.80 0.00 -0.07 -1.14 0.00 0.00 176.83 176.33 1req h LEU 412 N 0.96 0.01 -0.05 5.07 3.38 -0.98 -2.10 115.31 121.61 1req h LEU 412 Ca 0.24 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1req h LEU 412 Cb 0.14 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 1req h LEU 412 CO -0.03 0.28 -0.16 0.00 0.09 0.00 0.00 178.44 178.63 1req h ALA 413 N 0.73 -0.15 -0.54 1.53 0.00 -1.01 -0.88 119.26 118.94 1req h ALA 413 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1req h ALA 413 Cb 0.28 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1req h ALA 413 CO 0.00 -0.64 0.32 -0.44 0.00 0.00 0.00 179.25 178.49 1req h ASP 414 N -0.24 0.64 0.05 0.00 3.32 -1.17 -1.30 116.42 117.72 1req h ASP 414 Ca 0.07 -0.03 -0.27 0.00 0.02 0.00 0.00 57.03 56.81 1req h ASP 414 Cb 0.33 -0.16 0.02 0.00 0.22 0.00 0.00 39.33 39.74 1req h ASP 414 CO -0.19 0.50 -1.10 0.00 -1.72 0.00 0.00 179.24 176.73 1req h ALA 415 N 1.61 0.06 -0.09 3.45 0.00 -0.93 -2.15 119.26 121.22 1req h ALA 415 Ca 0.19 -0.72 -0.19 0.00 0.00 0.00 0.00 54.91 54.19 1req h ALA 415 Cb -0.02 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1req h ALA 415 CO -0.04 0.66 -0.74 0.00 0.00 0.00 0.00 179.25 179.13 1req h ALA 416 N 0.34 0.56 0.18 0.00 0.00 -1.14 -2.36 119.26 116.83 1req h ALA 416 Ca -0.15 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.14 1req h ALA 416 Cb 1.77 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1req h ALA 416 CO 0.21 0.75 -0.09 2.35 0.00 0.00 0.00 179.25 182.48 1req h TRP 417 N 0.31 -0.23 -0.91 0.00 2.91 -1.27 -0.53 115.95 116.24 1req h TRP 417 Ca -0.03 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.06 1req h TRP 417 Cb 1.32 0.08 -0.06 0.00 -0.51 0.00 0.00 29.16 29.98 1req h TRP 417 CO 0.05 -0.12 0.59 -0.22 -1.03 0.00 0.00 178.44 177.71 1req h LYS 418 N -0.27 0.95 -0.58 2.65 3.64 -1.39 0.27 116.57 121.84 1req h LYS 418 Ca -0.03 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.19 1req h LYS 418 Cb 0.21 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1req h LYS 418 CO 0.04 0.63 -0.05 1.49 -2.27 0.00 0.00 179.45 179.29 1req h GLU 419 N 0.98 1.06 -0.10 1.90 4.57 -1.10 -1.51 114.58 120.38 1req h GLU 419 Ca 0.41 -0.36 -0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1req h GLU 419 Cb 0.29 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 28.79 1req h GLU 419 CO -0.16 1.06 0.05 0.35 -1.18 0.00 0.00 179.01 179.13 1req h PHE 420 N 0.96 0.15 -0.08 0.92 3.57 -0.36 -0.90 116.94 121.19 1req h PHE 420 Ca 0.16 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.68 1req h PHE 420 Cb 0.62 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.28 1req h PHE 420 CO 0.04 0.19 -0.12 1.96 -2.23 0.00 0.00 178.31 178.16 1req h GLN 421 N 0.06 -0.15 -0.90 1.11 4.20 -0.90 -1.38 115.11 117.15 1req h GLN 421 Ca 0.04 0.01 0.18 0.00 0.06 0.00 0.00 58.65 58.94 1req h GLN 421 Cb 0.10 0.03 -0.11 0.00 0.30 0.00 0.00 27.48 27.81 1req h GLN 421 CO -0.01 -0.10 0.46 1.49 -0.67 0.00 0.00 178.83 180.00 1req h GLU 422 N -0.16 0.55 -0.42 1.46 4.81 -0.83 0.73 114.58 120.73 1req h GLU 422 Ca 0.07 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.22 1req h GLU 422 Cb 0.26 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1req h GLU 422 CO -0.18 0.37 0.08 0.28 -0.73 0.00 0.00 179.01 178.83 1req h VAL 423 N 0.57 1.20 -0.03 0.32 2.07 -0.78 -2.74 116.25 116.87 1req h VAL 423 Ca 0.52 -0.73 -0.15 0.00 0.82 0.00 0.00 66.70 67.17 1req h VAL 423 Cb 0.86 0.79 0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1req h VAL 423 CO -0.43 0.26 -0.57 -0.33 0.02 0.00 0.00 177.57 176.53 1req h GLU 424 N 0.62 0.43 0.00 1.57 4.39 0.19 0.38 114.58 122.16 1req h GLU 424 Ca 0.14 -0.43 -0.02 0.00 0.34 0.00 0.00 59.36 59.39 1req h GLU 424 Cb 0.27 0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.03 1req h GLU 424 CO 0.00 1.08 -0.09 -0.22 -1.16 0.00 0.00 179.01 178.63 1req h LYS 425 N -0.05 0.00 -0.02 2.33 1.63 -1.09 0.21 116.57 119.59 1req h LYS 425 Ca -0.06 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1req h LYS 425 Cb 1.26 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.89 1req h LYS 425 CO 0.11 0.09 0.00 1.28 -3.45 0.00 0.00 179.45 177.48 1req n LEU 426 N -3.62 0.45 0.00 5.20 4.77 -1.04 -4.91 117.00 117.84 1req n LEU 426 Ca -0.02 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1req n LEU 426 Cb 0.20 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1req n LEU 426 CO 0.29 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1req n GLY 427 N 0.99 0.92 0.00 -0.72 0.00 0.75 -4.75 105.19 102.38 1req n GLY 427 Ca 0.20 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.12 1.80 0.17 -0.02 0.00 0.13 -4.59 105.19 100.55 1req n GLY 428 Ca 0.00 -1.99 -0.05 0.00 0.00 0.00 0.00 46.02 43.98 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 0.00 0.24 -0.36 1.61 4.05 -1.79 0.33 114.93 119.01 1req h MET 429 Ca 0.00 -0.16 -0.02 0.00 -0.28 0.00 0.00 59.70 59.25 1req h MET 429 Cb 0.00 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 30.80 1req h MET 429 CO 0.00 0.75 0.16 0.77 0.23 0.00 0.00 176.91 178.82 1req h SER 430 N 0.18 0.48 -0.57 1.39 0.02 -1.92 -1.10 113.55 112.02 1req h SER 430 Ca -0.00 -0.14 -0.10 0.00 -0.84 0.00 0.00 61.79 60.70 1req h SER 430 Cb 1.07 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.47 1req h SER 430 CO 0.09 0.49 -0.04 0.11 -1.14 0.00 0.00 176.83 176.34 1req h LYS 431 N 0.44 1.05 -0.54 3.45 1.57 -1.76 -1.92 116.57 118.86 1req h LYS 431 Ca 0.12 -0.35 0.07 0.00 -1.87 0.00 0.00 60.65 58.62 1req h LYS 431 Cb 0.15 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.31 1req h LYS 431 CO -0.01 1.05 0.21 0.00 -0.57 0.00 0.00 179.45 180.12 1req h ALA 432 N 0.99 0.67 -0.50 3.86 0.00 -0.23 0.10 119.26 124.15 1req h ALA 432 Ca 0.16 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 1req h ALA 432 Cb 0.61 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1req h ALA 432 CO 0.04 -0.19 -0.15 0.28 0.00 0.00 0.00 179.25 179.23 1req h VAL 433 N 0.39 1.27 -0.36 0.00 2.07 -1.27 -3.17 116.25 115.18 1req h VAL 433 Ca 0.26 -1.30 -0.08 0.00 0.82 0.00 0.00 66.70 66.40 1req h VAL 433 Cb 0.28 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1req h VAL 433 CO -0.25 0.45 -0.08 0.24 0.02 0.00 0.00 177.57 177.96 1req h MET 434 N 0.84 0.70 0.00 1.57 2.86 -0.47 -3.44 114.93 116.99 1req h MET 434 Ca 0.12 -0.26 -0.07 0.00 -2.06 0.00 0.00 59.70 57.44 1req h MET 434 Cb 0.72 -0.04 0.03 0.00 0.06 0.00 0.00 31.60 32.37 1req h MET 434 CO 0.05 0.84 0.00 2.41 1.06 0.00 0.00 176.91 181.28 1req n THR 435 N -4.40 0.00 1.36 2.22 -1.04 0.26 -4.99 114.28 107.69 1req n THR 435 Ca -0.02 -0.06 0.13 0.00 -2.04 0.00 0.00 64.05 62.07 1req n THR 435 Cb 0.34 -0.75 0.41 0.00 -1.82 0.00 0.00 70.33 68.50 1req n THR 435 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1req n GLU 436 N -2.26 1.78 0.02 -2.82 -0.58 -1.26 -4.67 120.64 110.84 1req n GLU 436 Ca 0.03 -1.18 -0.10 0.00 -0.42 0.00 0.00 57.16 55.49 1req n GLU 436 Cb 0.10 -1.48 -0.04 0.00 -0.57 0.00 0.00 31.44 29.46 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 2.87 -0.76 -0.40 -0.32 2.76 -1.89 -1.19 115.15 116.22 1req h HIS 437 Ca 0.00 0.03 -0.05 0.00 -2.20 0.00 0.00 60.37 58.15 1req h HIS 437 Cb 0.63 0.35 -0.02 0.00 1.55 0.00 0.00 27.41 29.92 1req h HIS 437 CO 0.00 -0.36 0.06 0.28 -1.30 0.00 0.00 177.93 176.61 1req h VAL 438 N -0.37 1.24 -0.88 5.26 2.07 -1.82 -1.82 116.25 119.94 1req h VAL 438 Ca 0.09 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 1req h VAL 438 Cb 0.50 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 1req h VAL 438 CO -0.31 0.30 0.47 0.74 0.02 0.00 0.00 177.57 178.80 1req h THR 439 N 0.52 1.26 -0.33 2.57 2.02 -1.83 -1.26 112.91 115.85 1req h THR 439 Ca 0.12 -0.64 -0.03 0.00 0.77 0.00 0.00 66.41 66.62 1req h THR 439 Cb 0.38 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 1req h THR 439 CO 0.01 0.29 0.08 0.50 0.37 0.00 0.00 175.52 176.77 1req h LYS 440 N 1.23 0.53 -0.13 6.66 3.64 -0.87 -1.67 116.57 125.96 1req h LYS 440 Ca 0.31 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.53 1req h LYS 440 Cb 0.04 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1req h LYS 440 CO -0.05 0.59 -0.04 0.28 -2.27 0.00 0.00 179.45 177.96 1req h VAL 441 N 0.38 1.30 -0.78 2.00 2.07 -1.20 -2.55 116.25 117.46 1req h VAL 441 Ca 0.10 -1.01 0.12 0.00 0.82 0.00 0.00 66.70 66.73 1req h VAL 441 Cb 0.30 1.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 1req h VAL 441 CO 0.00 0.29 0.51 -0.07 0.02 0.00 0.00 177.57 178.33 1req h LEU 442 N -0.06 0.56 -0.67 2.57 3.38 -1.23 -1.75 115.31 118.10 1req h LEU 442 Ca 0.03 0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 1req h LEU 442 Cb 0.48 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1req h LEU 442 CO 0.01 0.31 -0.58 0.44 0.09 0.00 0.00 178.44 178.72 1req h ASP 443 N 0.61 0.30 -0.09 -0.43 3.32 -1.17 -0.84 116.42 118.12 1req h ASP 443 Ca 0.37 -0.17 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 1req h ASP 443 Cb 0.61 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.07 1req h ASP 443 CO -0.14 0.81 -0.04 0.00 -1.72 0.00 0.00 179.24 178.15 1req h ALA 444 N 1.19 0.13 0.05 3.45 0.00 -0.91 -1.66 119.26 121.52 1req h ALA 444 Ca -0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1req h ALA 444 Cb 1.07 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1req h ALA 444 CO 0.09 -0.11 -0.03 0.00 0.00 0.00 0.00 179.25 179.20 1req h ASN 446 N -0.15 0.78 -0.16 0.00 2.35 -1.19 0.18 115.58 117.39 1req h ASN 446 Ca -0.01 -0.10 -0.12 0.00 -0.55 0.00 0.00 56.30 55.52 1req h ASN 446 Cb 0.13 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.30 1req h ASN 446 CO 0.01 0.70 -0.37 0.00 -1.65 0.00 0.00 177.43 176.12 1req h ALA 447 N 1.41 0.26 -0.44 -0.83 0.00 -1.24 -1.70 119.26 116.72 1req h ALA 447 Ca 0.20 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1req h ALA 447 Cb 0.17 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1req h ALA 447 CO -0.02 0.34 -0.05 1.49 0.00 0.00 0.00 179.25 181.01 1req h GLU 448 N 0.17 0.82 -0.44 0.00 4.57 -1.14 -2.88 114.58 115.68 1req h GLU 448 Ca -0.00 -0.29 -0.01 0.00 -1.18 0.00 0.00 59.36 57.88 1req h GLU 448 Cb 0.98 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.49 1req h GLU 448 CO 0.08 0.91 0.24 -0.09 -1.18 0.00 0.00 179.01 178.97 1req h ARG 449 N 0.66 0.62 -0.64 1.92 2.43 -0.71 -2.43 114.38 116.22 1req h ARG 449 Ca 0.12 -0.07 0.05 0.00 -0.81 0.00 0.00 59.98 59.27 1req h ARG 449 Cb 0.57 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.96 1req h ARG 449 CO 0.03 0.49 0.42 0.00 -1.51 0.00 0.00 179.97 179.41 1req h ALA 450 N 1.09 1.73 -0.15 2.80 0.00 -1.30 0.53 119.26 123.97 1req h ALA 450 Ca 0.16 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1req h ALA 450 Cb 0.05 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1req h ALA 450 CO -0.03 0.17 -0.09 -0.22 0.00 0.00 0.00 179.25 179.09 1req h LYS 451 N 0.68 0.33 -0.29 0.00 3.64 -1.43 -1.93 116.57 117.57 1req h LYS 451 Ca 0.27 -0.15 -0.15 0.00 -1.27 0.00 0.00 60.65 59.35 1req h LYS 451 Cb 0.21 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1req h LYS 451 CO -0.08 0.66 -0.43 0.00 -2.27 0.00 0.00 179.45 177.33 1req h ARG 452 N -0.02 0.72 -0.52 1.90 3.08 -0.75 -2.10 114.38 116.69 1req h ARG 452 Ca 0.03 -0.39 -0.04 0.00 0.07 0.00 0.00 59.98 59.66 1req h ARG 452 Cb 0.57 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 1req h ARG 452 CO 0.03 1.01 0.18 -0.07 -1.07 0.00 0.00 179.97 180.05 1req h LEU 453 N 0.58 0.74 -0.63 3.04 3.38 -1.01 -0.79 115.31 120.62 1req h LEU 453 Ca 0.04 -0.19 -0.15 0.00 0.09 0.00 0.00 57.88 57.68 1req h LEU 453 Cb 0.98 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1req h LEU 453 CO 0.09 0.73 -0.56 0.00 0.09 0.00 0.00 178.44 178.78 1req h ALA 454 N 1.04 0.81 -0.03 1.53 0.00 -1.29 -3.06 119.26 118.27 1req h ALA 454 Ca 0.17 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1req h ALA 454 Cb 0.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1req h ALA 454 CO -0.01 0.70 0.00 0.27 0.00 0.00 0.00 179.25 180.21 1req n ASN 455 N -3.92 1.55 -3.05 0.00 0.23 -0.80 -1.28 115.26 107.99 1req n ASN 455 Ca -0.03 -1.53 -0.23 0.00 -0.53 0.00 0.00 54.58 52.27 1req n ASN 455 Cb 0.60 -0.01 0.03 0.00 -2.08 0.00 0.00 39.78 38.32 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 0.21 -4.73 0.00 -3.83 1.74 -0.79 -4.44 116.66 104.81 1req n ARG 456 Ca 0.19 0.87 0.13 0.00 -0.77 0.00 0.00 57.85 58.26 1req n ARG 456 Cb 0.36 -5.72 0.42 0.00 -1.02 0.00 0.00 32.46 26.50 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 -4.00 0.02 -3.75 5.56 5.02 -0.37 -3.19 118.16 117.45 1req n LYS 457 Ca -0.10 -0.01 -0.28 0.00 -2.02 0.00 0.00 58.31 55.90 1req n LYS 457 Cb 0.61 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 34.01 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 1.94 0.76 1.97 0.74 -0.84 -4.97 119.66 116.26 1req s GLN 458 Ca 0.13 -2.90 -0.11 0.00 0.05 0.00 0.00 55.36 52.53 1req s GLN 458 Cb 0.18 -2.78 0.05 0.00 1.10 0.00 0.00 33.01 31.56 1req s GLN 458 CO 0.62 -1.30 1.10 -1.25 -0.55 0.00 0.00 175.29 173.91 1req s PRO 459 N -0.89 2.28 -0.21 1.67 0.04 -1.19 -4.23 135.00 132.47 1req s PRO 459 Ca 0.26 1.23 0.02 0.00 0.04 0.00 0.00 61.00 62.55 1req s PRO 459 Cb -0.04 -1.90 0.04 0.00 0.04 0.00 0.00 34.50 32.65 1req s PRO 459 CO -0.16 -1.64 -0.14 0.42 0.04 0.00 0.00 177.00 175.53 1req s ILE 460 N -2.79 1.95 0.05 0.56 1.01 -1.26 -5.02 121.20 115.70 1req s ILE 460 Ca 0.63 -1.20 -0.35 0.00 0.00 0.00 0.00 60.65 59.73 1req s ILE 460 Cb -0.18 -1.95 -0.14 0.00 0.01 0.00 0.00 42.46 40.20 1req s ILE 460 CO 0.54 0.22 1.65 0.41 0.00 0.00 0.00 174.94 177.76 1req n THR 461 N 4.58 0.20 -1.14 2.92 -1.04 -1.26 -1.42 114.28 117.11 1req n THR 461 Ca -0.16 -0.04 -0.05 0.00 -2.04 0.00 0.00 64.05 61.76 1req n THR 461 Cb 0.46 -1.54 -0.02 0.00 -1.82 0.00 0.00 70.33 67.41 1req n THR 461 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1req n ALA 462 N 4.42 -0.08 0.10 2.41 0.00 -0.64 -4.76 120.51 121.97 1req n ALA 462 Ca 0.19 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1req n ALA 462 Cb 0.27 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.76 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 -2.64 0.55 0.44 0.00 0.31 -0.74 -4.31 118.33 111.95 1req n VAL 463 Ca -0.05 0.18 0.05 0.00 -0.01 0.00 0.00 64.34 64.51 1req n VAL 463 Cb 0.27 -1.01 -0.06 0.00 -0.91 0.00 0.00 33.84 32.13 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 -3.47 0.74 -4.00 4.52 3.41 -0.51 -4.57 113.62 109.74 1req n SER 464 Ca 0.00 -0.66 -0.26 0.00 -0.26 0.00 0.00 58.87 57.69 1req n SER 464 Cb 0.01 1.06 -0.17 0.00 -0.26 0.00 0.00 64.21 64.85 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 -2.10 1.74 -1.12 4.33 0.41 -1.17 -4.86 118.70 115.93 1req s GLU 465 Ca 0.03 -0.40 -0.26 0.00 -0.41 0.00 0.00 54.97 53.93 1req s GLU 465 Cb 0.08 -1.52 0.04 0.00 -1.78 0.00 0.00 34.13 30.95 1req s GLU 465 CO 0.44 -0.05 0.50 1.19 -0.49 0.00 0.00 175.26 176.85 1req n PHE 466 N 4.12 -1.18 -1.33 1.61 3.72 -1.26 -1.62 117.46 121.53 1req n PHE 466 Ca -0.20 0.12 -0.29 0.00 -0.05 0.00 0.00 57.45 57.03 1req n PHE 466 Cb 0.51 -2.43 0.16 0.00 -0.94 0.00 0.00 39.48 36.78 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 -7.17 0.77 -0.14 -1.08 0.04 -1.26 -4.46 135.00 121.70 1req s PRO 467 Ca 0.37 0.43 -0.03 0.00 0.04 0.00 0.00 61.00 61.81 1req s PRO 467 Cb -0.21 -1.78 0.05 0.00 0.04 0.00 0.00 34.50 32.60 1req s PRO 467 CO 0.87 -2.48 0.04 1.41 0.04 0.00 0.00 177.00 176.87 1req s MET 468 N -5.09 0.49 0.16 4.56 1.75 -1.26 -4.98 119.30 114.92 1req s MET 468 Ca 0.65 -0.15 -0.33 0.00 -1.25 0.00 0.00 55.69 54.60 1req s MET 468 Cb -0.17 -1.61 -0.13 0.00 2.84 0.00 0.00 34.83 35.76 1req s MET 468 CO 0.56 -0.52 1.65 -0.89 -0.65 0.00 0.00 175.02 175.17 1req n ILE 469 N 5.14 0.06 -1.15 10.11 5.41 -1.26 -2.36 119.36 135.31 1req n ILE 469 Ca -0.08 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.66 1req n ILE 469 Cb 0.49 -1.72 0.00 0.00 -0.71 0.00 0.00 39.64 37.70 1req n ILE 469 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1req n GLY 470 N 3.68 0.54 3.74 7.39 0.00 -1.26 -4.99 105.19 114.28 1req n GLY 470 Ca 0.17 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 1req n GLY 470 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req s ALA 471 N -2.00 3.83 0.09 4.61 0.00 -0.99 -4.82 121.76 122.48 1req s ALA 471 Ca 0.00 1.57 -0.37 0.00 0.00 0.00 0.00 51.96 53.16 1req s ALA 471 Cb 0.00 -3.67 -0.16 0.00 0.00 0.00 0.00 23.12 19.29 1req s ALA 471 CO 0.00 -0.94 1.37 -2.13 0.00 0.00 0.00 175.76 174.05 1req n ARG 472 N 3.08 1.23 -0.88 0.00 0.63 -1.26 -4.63 116.66 114.82 1req n ARG 472 Ca 0.12 0.44 0.00 0.00 -0.92 0.00 0.00 57.85 57.49 1req n ARG 472 Cb 0.36 -2.10 0.00 0.00 0.45 0.00 0.00 32.46 31.18 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 2.64 1.66 -3.80 6.15 2.88 -1.26 -4.27 113.62 117.63 1req n SER 473 Ca 0.18 -0.48 -0.13 0.00 -1.33 0.00 0.00 58.87 57.11 1req n SER 473 Cb 0.20 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.56 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 0.29 0.04 -0.10 2.46 2.07 -1.26 -5.04 121.20 119.66 1req s ILE 474 Ca 0.00 -0.34 -0.29 0.00 -1.41 0.00 0.00 60.65 58.60 1req s ILE 474 Cb 0.00 -0.48 -0.04 0.00 0.13 0.00 0.00 42.46 42.07 1req s ILE 474 CO 0.00 -0.19 1.50 -1.61 -1.91 0.00 0.00 174.94 172.73 1req s GLU 475 N -0.77 4.20 0.44 3.50 0.41 -1.26 -5.02 118.70 120.20 1req s GLU 475 Ca -0.09 1.98 0.04 0.00 -0.41 0.00 0.00 54.97 56.49 1req s GLU 475 Cb -0.05 -3.90 -0.04 0.00 -1.78 0.00 0.00 34.13 28.36 1req s GLU 475 CO 0.02 -0.80 0.03 0.95 -0.49 0.00 0.00 175.26 174.98 1req s THR 476 N 3.84 1.34 -0.12 3.63 -4.23 -1.26 -4.40 115.64 114.43 1req s THR 476 Ca 0.66 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 59.12 1req s THR 476 Cb -0.29 -2.53 -0.04 0.00 1.34 0.00 0.00 72.50 70.98 1req s THR 476 CO 0.24 0.00 0.06 -0.54 -0.54 0.00 0.00 174.62 173.83 1req s LYS 477 N -3.80 3.39 0.51 3.99 1.02 0.12 -4.85 119.74 120.11 1req s LYS 477 Ca 0.22 -0.31 -0.22 0.00 0.02 0.00 0.00 55.97 55.68 1req s LYS 477 Cb 0.05 -3.02 -0.07 0.00 -0.52 0.00 0.00 37.83 34.27 1req s LYS 477 CO 0.11 0.61 1.11 -2.30 -0.92 0.00 0.00 175.35 173.95 1req n PRO 478 N 2.48 1.36 -2.56 -1.68 -0.02 -1.26 0.21 135.00 133.52 1req n PRO 478 Ca -0.18 0.50 -0.40 0.00 -2.02 0.00 0.00 63.50 61.39 1req n PRO 478 Cb 0.54 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.72 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 -1.35 3.69 0.52 6.00 0.08 -1.26 -4.60 117.98 121.06 1req s PHE 479 Ca 0.69 1.76 -0.22 0.00 0.12 0.00 0.00 56.93 59.28 1req s PHE 479 Cb -0.47 -3.18 -0.05 0.00 -0.57 0.00 0.00 43.02 38.74 1req s PHE 479 CO 0.52 -0.24 1.34 -2.14 -0.10 0.00 0.00 175.22 174.60 1req s PRO 480 N -1.42 3.28 0.33 0.24 0.02 -1.26 -4.91 135.00 131.27 1req s PRO 480 Ca 0.44 2.20 -0.29 0.00 0.02 0.00 0.00 61.00 63.37 1req s PRO 480 Cb -0.30 -2.32 -0.11 0.00 0.02 0.00 0.00 34.50 31.79 1req s PRO 480 CO 0.38 -1.07 1.44 0.00 -0.33 0.00 0.00 177.00 177.42 1req s ALA 481 N -1.32 3.59 -0.11 -1.55 0.00 -1.26 -4.85 121.76 116.26 1req s ALA 481 Ca 0.69 1.44 0.01 0.00 0.00 0.00 0.00 51.96 54.10 1req s ALA 481 Cb -0.39 -3.57 -0.02 0.00 0.00 0.00 0.00 23.12 19.14 1req s ALA 481 CO 0.47 -0.87 -0.14 0.00 0.00 0.00 0.00 175.76 175.22 1req s ALA 482 N -0.75 2.60 0.37 0.00 0.00 -1.26 -4.47 121.76 118.26 1req s ALA 482 Ca 0.54 -0.91 -0.26 0.00 0.00 0.00 0.00 51.96 51.33 1req s ALA 482 Cb -0.44 -1.13 -0.12 0.00 0.00 0.00 0.00 23.12 21.43 1req s ALA 482 CO 0.54 0.32 1.11 -2.30 0.00 0.00 0.00 175.76 175.44 1req n PRO 483 N 3.24 1.61 -0.91 0.00 -0.02 -1.26 -4.93 135.00 132.73 1req n PRO 483 Ca -0.18 0.57 -0.33 0.00 -2.02 0.00 0.00 63.50 61.55 1req n PRO 483 Cb 0.53 -2.11 0.14 0.00 -0.02 0.00 0.00 33.50 32.04 1req n PRO 483 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1req n ALA 484 N -0.11 -0.56 -2.51 3.55 0.00 -1.26 -5.04 120.51 114.59 1req n ALA 484 Ca 0.08 -0.44 -0.20 0.00 0.00 0.00 0.00 53.44 52.88 1req n ALA 484 Cb 0.37 -2.19 -0.11 0.00 0.00 0.00 0.00 19.45 17.52 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 -4.25 1.10 0.00 0.00 0.52 -1.26 -5.05 118.95 110.00 1req s ARG 485 Ca 0.70 -1.25 0.17 0.00 -0.52 0.00 0.00 55.73 54.82 1req s ARG 485 Cb -0.26 -1.11 -0.18 0.00 0.52 0.00 0.00 34.95 33.91 1req s ARG 485 CO 0.55 0.23 0.72 1.63 0.02 0.00 0.00 175.30 178.45 1req n LYS 486 N 0.61 1.39 0.00 3.54 5.02 -1.21 -4.98 118.16 122.54 1req n LYS 486 Ca -0.16 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.13 1req n LYS 486 Cb 0.56 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 34.27 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 1.40 1.60 3.64 0.72 0.00 -0.83 -4.60 105.19 107.11 1req n GLY 487 Ca 0.03 -1.78 -0.63 0.00 0.00 0.00 0.00 46.02 43.64 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 0.75 -4.74 0.99 4.77 0.07 -4.88 117.00 113.96 1req n LEU 488 Ca 0.00 1.17 -0.40 0.00 -0.03 0.00 0.00 56.01 56.75 1req n LEU 488 Cb 0.00 -0.92 -0.05 0.00 -2.33 0.00 0.00 43.42 40.13 1req n LEU 488 CO 0.00 -1.29 0.55 0.00 -1.33 0.00 0.00 177.39 175.33 1req s ALA 489 N 1.67 3.33 -0.31 -1.18 0.00 -1.26 -4.90 121.76 119.10 1req s ALA 489 Ca 0.98 0.42 -0.05 0.00 0.00 0.00 0.00 51.96 53.30 1req s ALA 489 Cb -1.37 -3.11 0.03 0.00 0.00 0.00 0.00 23.12 18.67 1req s ALA 489 CO 0.70 0.05 0.06 -1.58 0.00 0.00 0.00 175.76 174.99 1req s TRP 490 N -0.16 3.20 -0.03 0.00 0.52 -1.26 -4.12 118.94 117.08 1req s TRP 490 Ca 0.42 -1.35 0.00 0.00 0.02 0.00 0.00 56.10 55.19 1req s TRP 490 Cb -0.22 -2.22 0.03 0.00 -1.15 0.00 0.00 33.47 29.91 1req s TRP 490 CO 0.26 -0.69 0.00 -1.01 0.02 0.00 0.00 176.95 175.54 1req s HIS 491 N 1.41 0.33 0.56 -1.98 3.76 -1.21 -5.02 115.29 113.15 1req s HIS 491 Ca -0.01 0.00 -0.18 0.00 -0.15 0.00 0.00 55.06 54.73 1req s HIS 491 Cb -0.18 -0.45 -0.05 0.00 1.11 0.00 0.00 32.58 33.01 1req s HIS 491 CO 0.01 -0.15 1.09 1.03 -0.85 0.00 0.00 174.74 175.87 1req s ARG 492 N 1.17 3.34 0.37 1.40 0.52 -1.26 -4.87 118.95 119.62 1req s ARG 492 Ca -0.08 1.43 0.08 0.00 -0.52 0.00 0.00 55.73 56.64 1req s ARG 492 Cb -0.13 -2.02 0.81 0.00 0.52 0.00 0.00 34.95 34.13 1req s ARG 492 CO -0.02 -0.83 1.93 -0.44 0.02 0.00 0.00 175.30 175.96 1req h ASP 493 N 0.89 0.62 -0.06 0.23 3.32 -1.55 -2.78 116.42 117.09 1req h ASP 493 Ca -0.49 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1req h ASP 493 Cb 1.24 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1req h ASP 493 CO 0.57 0.37 0.00 -1.54 -1.72 0.00 0.00 179.24 176.92 1req n SER 494 N -4.50 1.49 -0.26 6.45 3.41 -1.26 -4.41 113.62 114.53 1req n SER 494 Ca 0.13 -1.54 0.04 0.00 -0.26 0.00 0.00 58.87 57.24 1req n SER 494 Cb 0.34 -0.03 0.18 0.00 -0.26 0.00 0.00 64.21 64.44 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 2.22 0.54 -0.99 4.33 5.08 -1.86 -1.14 114.58 122.77 1req h GLU 495 Ca 0.00 -0.03 0.16 0.00 -1.00 0.00 0.00 59.36 58.49 1req h GLU 495 Cb 0.48 -0.12 -0.09 0.00 0.50 0.00 0.00 28.75 29.51 1req h GLU 495 CO 0.00 0.36 0.62 -0.24 -1.00 0.00 0.00 179.01 178.74 1req h VAL 496 N 0.56 0.79 -0.02 3.13 3.04 -1.83 -0.52 116.25 121.39 1req h VAL 496 Ca 0.41 -0.28 -0.24 0.00 -1.01 0.00 0.00 66.70 65.58 1req h VAL 496 Cb 0.54 -0.09 0.01 0.00 -2.01 0.00 0.00 31.29 29.73 1req h VAL 496 CO -0.34 0.15 -0.94 -0.26 -1.01 0.00 0.00 177.57 175.17 1req h PHE 497 N 0.81 0.80 -0.43 3.17 0.04 -1.73 -2.83 116.94 116.77 1req h PHE 497 Ca 0.53 -0.42 -0.07 0.00 2.80 0.00 0.00 57.97 60.81 1req h PHE 497 Cb 0.76 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.80 1req h PHE 497 CO -0.00 1.24 -0.03 0.93 -0.60 0.00 0.00 178.31 179.85 1req h GLU 498 N 0.32 0.71 -0.47 1.51 5.08 -0.65 -0.31 114.58 120.78 1req h GLU 498 Ca -0.09 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.04 1req h GLU 498 Cb 1.57 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.72 1req h GLU 498 CO 0.17 0.74 0.16 1.96 -1.00 0.00 0.00 179.01 181.04 1req h GLN 499 N 0.66 0.72 -0.78 2.33 4.20 -1.05 -0.36 115.11 120.82 1req h GLN 499 Ca 0.13 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.64 1req h GLN 499 Cb 0.45 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.09 1req h GLN 499 CO 0.02 0.68 0.31 -0.07 -0.67 0.00 0.00 178.83 179.10 1req h LEU 500 N 0.62 1.08 -0.90 1.46 3.38 -1.22 -1.93 115.31 117.81 1req h LEU 500 Ca 0.15 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.01 1req h LEU 500 Cb 0.25 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 1req h LEU 500 CO -0.01 0.96 0.57 0.24 0.09 0.00 0.00 178.44 180.29 1req h MET 501 N 1.14 1.03 -0.52 1.13 2.86 -0.96 -2.16 114.93 117.45 1req h MET 501 Ca 0.26 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.74 1req h MET 501 Cb 0.22 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 1req h MET 501 CO -0.02 0.68 -0.09 -0.44 1.06 0.00 0.00 176.91 178.10 1req h ASP 502 N 1.06 0.94 -0.23 1.22 3.32 -0.33 -2.10 116.42 120.29 1req h ASP 502 Ca 0.38 -0.29 0.06 0.00 0.02 0.00 0.00 57.03 57.20 1req h ASP 502 Cb 0.12 -0.25 -0.07 0.00 0.22 0.00 0.00 39.33 39.35 1req h ASP 502 CO -0.16 1.05 -0.24 0.03 -1.72 0.00 0.00 179.24 178.20 1req h ARG 503 N 0.85 -0.24 0.00 3.56 3.08 -0.71 -2.12 114.38 118.80 1req h ARG 503 Ca 0.14 0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 1req h ARG 503 Cb 0.63 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 1req h ARG 503 CO 0.04 -0.16 -0.19 0.77 -1.07 0.00 0.00 179.97 179.36 1req h SER 504 N -0.25 0.00 1.13 7.04 0.02 -1.48 -2.95 113.55 117.06 1req h SER 504 Ca 0.13 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.96 1req h SER 504 Cb 0.45 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 1req h SER 504 CO -0.38 0.19 -0.58 0.74 -1.14 0.00 0.00 176.83 175.67 1req h THR 505 N 0.00 1.09 -0.21 -2.27 2.02 -1.19 -3.32 112.91 109.03 1req h THR 505 Ca -0.00 -2.26 -0.01 0.00 0.77 0.00 0.00 66.41 64.91 1req h THR 505 Cb 0.45 2.34 -0.01 0.00 -1.74 0.00 0.00 68.15 69.20 1req h THR 505 CO 0.02 0.56 0.09 0.77 0.37 0.00 0.00 175.52 177.34 1req h SER 506 N 0.00 0.28 -4.14 4.18 4.64 -1.20 -3.43 113.55 113.88 1req h SER 506 Ca -0.01 -0.15 -0.51 0.00 -0.47 0.00 0.00 61.79 60.66 1req h SER 506 Cb 1.30 -0.07 0.09 0.00 -0.31 0.00 0.00 62.40 63.41 1req h SER 506 CO 0.07 0.36 0.41 -0.69 -0.87 0.00 0.00 176.83 176.11 1req s VAL 507 N -5.60 3.14 0.13 0.95 1.01 -1.25 -4.98 120.40 113.81 1req s VAL 507 Ca -0.14 0.62 -0.14 0.00 0.00 0.00 0.00 61.98 62.32 1req s VAL 507 Cb 0.08 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 1req s VAL 507 CO 0.71 -0.24 1.59 0.77 0.00 0.00 0.00 175.10 177.92 1req h SER 508 N 0.60 0.71 -3.66 3.32 4.64 -1.89 -3.40 113.55 113.86 1req h SER 508 Ca -0.48 -0.30 -0.65 0.00 -0.47 0.00 0.00 61.79 59.89 1req h SER 508 Cb 1.26 -0.19 -0.22 0.00 -0.31 0.00 0.00 62.40 62.93 1req h SER 508 CO 0.55 0.83 -0.60 -0.70 -0.87 0.00 0.00 176.83 176.04 1req s GLU 509 N -5.05 3.58 0.22 4.77 -6.30 -1.26 -5.08 118.70 109.58 1req s GLU 509 Ca -0.13 -0.53 -0.32 0.00 -2.50 0.00 0.00 54.97 51.49 1req s GLU 509 Cb 0.10 -3.40 -0.12 0.00 0.00 0.00 0.00 34.13 30.71 1req s GLU 509 CO 0.79 -0.25 1.68 -2.13 0.02 0.00 0.00 175.26 175.38 1req n ARG 510 N 4.94 2.68 -1.63 4.30 0.63 -1.26 -4.93 116.66 121.39 1req n ARG 510 Ca -0.15 0.96 -0.42 0.00 -0.92 0.00 0.00 57.85 57.32 1req n ARG 510 Cb 0.51 -2.79 0.01 0.00 0.45 0.00 0.00 32.46 30.64 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 3.55 1.48 -4.76 -0.14 -0.02 -1.26 -4.78 135.00 129.07 1req n PRO 511 Ca 0.15 0.53 -0.25 0.00 -2.02 0.00 0.00 63.50 61.91 1req n PRO 511 Cb 0.34 -2.09 -0.15 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 -1.99 1.38 -0.11 -0.52 1.02 -1.26 -0.63 119.74 117.62 1req s LYS 512 Ca 0.62 -0.71 -0.00 0.00 0.02 0.00 0.00 55.97 55.90 1req s LYS 512 Cb -0.56 -1.37 0.02 0.00 -0.52 0.00 0.00 37.83 35.40 1req s LYS 512 CO 0.58 0.37 -0.09 0.08 -0.92 0.00 0.00 175.35 175.37 1req s VAL 513 N -0.53 1.09 -0.15 3.17 1.01 -0.19 -4.55 120.40 120.24 1req s VAL 513 Ca 0.06 -0.34 -0.26 0.00 0.00 0.00 0.00 61.98 61.44 1req s VAL 513 Cb -0.07 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 1req s VAL 513 CO -0.00 0.37 0.87 0.12 0.00 0.00 0.00 175.10 176.46 1req s PHE 514 N 1.56 3.45 -0.36 5.22 5.36 0.08 -3.79 117.98 129.49 1req s PHE 514 Ca 0.03 1.34 -0.21 0.00 -0.96 0.00 0.00 56.93 57.12 1req s PHE 514 Cb -0.13 -3.04 0.00 0.00 -0.34 0.00 0.00 43.02 39.51 1req s PHE 514 CO -0.07 -0.22 0.66 -0.51 -1.46 0.00 0.00 175.22 173.62 1req s LEU 515 N 2.05 4.25 -0.96 6.12 1.43 -0.29 -0.41 118.68 130.85 1req s LEU 515 Ca 0.41 0.15 -0.18 0.00 -1.03 0.00 0.00 54.13 53.48 1req s LEU 515 Cb -0.17 -2.82 0.14 0.00 0.03 0.00 0.00 46.19 43.38 1req s LEU 515 CO 0.14 -0.62 1.15 0.00 0.23 0.00 0.00 176.35 177.24 1req s ALA 516 N 2.77 3.52 -0.11 4.21 0.00 -0.30 -1.81 121.76 130.04 1req s ALA 516 Ca 0.25 -2.90 -0.24 0.00 0.00 0.00 0.00 51.96 49.07 1req s ALA 516 Cb -0.14 -4.02 -0.03 0.00 0.00 0.00 0.00 23.12 18.93 1req s ALA 516 CO 0.15 -2.90 0.76 0.00 0.00 0.00 0.00 175.76 173.77 1req s LEU 518 N 1.35 3.64 0.00 0.00 1.43 -0.90 -0.19 118.68 124.01 1req s LEU 518 Ca 0.38 0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.63 1req s LEU 518 Cb -0.17 -1.87 0.00 0.00 0.03 0.00 0.00 46.19 44.17 1req s LEU 518 CO 0.16 0.37 0.00 0.61 0.23 0.00 0.00 176.35 177.72 1req n GLY 519 N 2.02 -0.43 3.99 -3.19 0.00 -1.26 -4.17 105.19 102.14 1req n GLY 519 Ca -0.18 -1.37 -0.19 0.00 0.00 0.00 0.00 46.02 44.28 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 2.84 0.43 2.61 -4.23 -1.26 -3.84 115.64 112.19 1req s THR 520 Ca 0.00 -0.85 0.25 0.00 -1.18 0.00 0.00 61.69 59.91 1req s THR 520 Cb 0.00 -3.00 0.28 0.00 1.34 0.00 0.00 72.50 71.12 1req s THR 520 CO 0.00 0.00 2.07 -0.09 -0.54 0.00 0.00 174.62 176.06 1req h ARG 521 N 0.38 0.00 -0.31 3.99 2.43 -1.95 -1.93 114.38 116.99 1req h ARG 521 Ca -0.41 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 58.72 1req h ARG 521 Cb 1.29 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.82 1req h ARG 521 CO 0.48 0.13 0.02 0.00 -1.51 0.00 0.00 179.97 179.09 1req h ARG 522 N 0.00 0.47 0.02 0.20 3.08 -1.98 -1.84 114.38 114.33 1req h ARG 522 Ca -0.00 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1req h ARG 522 Cb 0.32 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1req h ARG 522 CO 0.02 0.49 -0.01 -0.44 -1.07 0.00 0.00 179.97 178.95 1req h ASP 523 N 0.46 -0.02 0.51 7.04 3.32 -1.75 -3.43 116.42 122.55 1req h ASP 523 Ca 0.10 -0.72 0.00 0.00 0.02 0.00 0.00 57.03 56.43 1req h ASP 523 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1req h ASP 523 CO 0.01 0.81 -1.10 2.22 -1.72 0.00 0.00 179.24 179.45 1req n PHE 524 N -4.69 0.38 -0.28 4.55 1.16 -0.78 -2.78 117.46 115.03 1req n PHE 524 Ca -0.08 0.11 -0.09 0.00 -1.87 0.00 0.00 57.45 55.52 1req n PHE 524 Cb 0.36 -0.55 -0.05 0.00 -1.61 0.00 0.00 39.48 37.62 1req n PHE 524 CO 0.00 0.00 0.00 0.78 -1.87 0.00 0.00 176.76 175.67 1req h GLY 525 N 4.38 -0.58 -0.43 4.97 0.00 -1.58 0.10 103.07 109.94 1req h GLY 525 Ca 0.00 0.65 0.04 0.00 0.00 0.00 0.00 47.33 48.02 1req h GLY 525 CO 0.00 -0.10 -0.27 -1.33 0.00 0.00 0.00 176.54 174.84 1req h GLY 526 N -0.16 -1.83 1.70 4.60 0.00 -1.84 0.21 103.07 105.74 1req h GLY 526 Ca 0.18 0.98 -0.10 0.00 0.00 0.00 0.00 47.33 48.39 1req h GLY 526 CO -0.78 -0.53 -0.34 3.21 0.00 0.00 0.00 176.54 178.10 1req h ARG 527 N -0.02 0.34 -0.20 4.80 -0.00 -1.72 -2.40 114.38 115.18 1req h ARG 527 Ca 0.07 -0.14 -0.18 0.00 -0.50 0.00 0.00 59.98 59.23 1req h ARG 527 Cb 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 29.97 30.15 1req h ARG 527 CO -0.41 0.64 -0.59 1.49 0.00 0.00 0.00 179.97 181.10 1req h GLU 528 N 0.29 0.65 -0.78 0.04 4.22 -0.58 -1.17 114.58 117.25 1req h GLU 528 Ca 0.04 -0.43 -0.01 0.00 0.08 0.00 0.00 59.36 59.04 1req h GLU 528 Cb 0.74 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.01 1req h GLU 528 CO 0.06 1.05 0.46 0.78 -2.18 0.00 0.00 179.01 179.18 1req h GLY 529 N 0.94 1.14 0.50 1.92 0.00 -0.12 -2.54 103.07 104.91 1req h GLY 529 Ca 0.00 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 1req h GLY 529 CO 0.12 0.46 -0.01 -2.75 0.00 0.00 0.00 176.54 174.36 1req h PHE 530 N 1.08 0.02 0.14 5.60 3.57 -1.30 -3.41 116.94 122.64 1req h PHE 530 Ca 0.28 -0.01 -0.28 0.00 3.53 0.00 0.00 57.97 61.49 1req h PHE 530 Cb -0.03 -0.00 0.01 0.00 2.79 0.00 0.00 35.95 38.72 1req h PHE 530 CO 0.00 0.52 -1.25 0.77 -2.23 0.00 0.00 178.31 176.12 1req h SER 531 N -0.49 0.54 0.01 0.41 0.02 -1.05 -3.31 113.55 109.68 1req h SER 531 Ca 0.00 -0.55 0.02 0.00 -0.84 0.00 0.00 61.79 60.42 1req h SER 531 Cb 0.52 -0.17 -0.06 0.00 0.14 0.00 0.00 62.40 62.83 1req h SER 531 CO 0.00 1.42 -0.52 -1.28 -1.14 0.00 0.00 176.83 175.31 1req h SER 532 N 0.12 -1.58 -0.91 3.07 0.87 -1.70 -1.76 113.55 111.65 1req h SER 532 Ca -0.15 0.18 0.10 0.00 -1.23 0.00 0.00 61.79 60.69 1req h SER 532 Cb 1.96 0.60 -0.07 0.00 -0.44 0.00 0.00 62.40 64.45 1req h SER 532 CO 0.21 -0.52 0.58 -0.65 -0.53 0.00 0.00 176.83 175.93 1req h PRO 533 N -0.67 0.86 -0.16 2.24 0.11 -1.79 -1.80 132.00 130.79 1req h PRO 533 Ca 0.02 -0.05 0.05 0.00 0.11 0.00 0.00 66.00 66.13 1req h PRO 533 Cb 0.72 -0.19 -0.06 0.00 0.11 0.00 0.00 31.00 31.58 1req h PRO 533 CO -0.35 0.57 -0.22 0.28 -0.21 0.00 0.00 178.00 178.07 1req h VAL 534 N 0.89 0.45 -0.88 3.15 2.07 -1.42 -1.53 116.25 118.97 1req h VAL 534 Ca 0.43 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.93 1req h VAL 534 Cb 0.44 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 1req h VAL 534 CO -0.19 0.00 0.46 -0.50 0.02 0.00 0.00 177.57 177.36 1req h TRP 535 N -0.26 1.22 0.00 1.57 4.06 -1.16 -1.84 115.95 119.54 1req h TRP 535 Ca 0.11 -0.04 -0.00 0.00 2.06 0.00 0.00 58.89 61.02 1req h TRP 535 Cb 0.43 -0.39 -0.00 0.00 -1.00 0.00 0.00 29.16 28.20 1req h TRP 535 CO -0.34 0.86 -0.02 0.45 -3.56 0.00 0.00 178.44 175.83 1req h HIS 536 N 1.23 0.00 -0.61 0.49 3.86 -0.43 -2.72 115.15 116.97 1req h HIS 536 Ca 0.31 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.64 1req h HIS 536 Cb 0.06 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 28.44 1req h HIS 536 CO 0.01 0.02 0.11 0.82 0.86 0.00 0.00 177.93 179.75 1req h ILE 537 N 0.00 0.60 -0.30 2.45 2.04 -0.62 -1.71 117.51 119.97 1req h ILE 537 Ca -0.00 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.78 1req h ILE 537 Cb 0.23 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1req h ILE 537 CO 0.00 0.04 0.00 0.00 0.00 0.00 0.00 178.15 178.20 1req n ALA 538 N -2.63 2.47 -2.46 1.87 0.00 -1.16 -4.50 120.51 114.09 1req n ALA 538 Ca 0.09 -0.62 -0.12 0.00 0.00 0.00 0.00 53.44 52.80 1req n ALA 538 Cb 0.34 -1.01 0.01 0.00 0.00 0.00 0.00 19.45 18.79 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 1.11 -0.02 3.58 0.00 0.00 -0.64 -3.94 105.19 105.28 1req n GLY 539 Ca 0.14 -0.35 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.73 5.13 0.76 -0.61 1.01 -1.03 -4.61 121.20 119.11 1req s ILE 540 Ca 0.09 0.41 -0.14 0.00 0.00 0.00 0.00 60.65 61.00 1req s ILE 540 Cb -0.04 -3.80 0.05 0.00 0.01 0.00 0.00 42.46 38.68 1req s ILE 540 CO 0.11 0.00 1.20 -1.81 0.00 0.00 0.00 174.94 174.44 1req s ASP 541 N 1.69 4.04 -0.51 3.58 1.01 0.19 -3.69 116.67 122.98 1req s ASP 541 Ca 0.15 2.32 0.05 0.00 0.71 0.00 0.00 52.55 55.78 1req s ASP 541 Cb -0.16 -2.58 0.20 0.00 1.01 0.00 0.00 42.92 41.39 1req s ASP 541 CO 0.11 -2.36 0.48 0.35 0.21 0.00 0.00 175.17 173.95 1req n THR 542 N -2.95 0.07 -1.34 -1.27 -2.24 -1.26 -1.03 114.28 104.27 1req n THR 542 Ca 0.13 -4.15 -0.34 0.00 -2.27 0.00 0.00 64.05 57.42 1req n THR 542 Cb 0.51 -1.91 0.10 0.00 -2.10 0.00 0.00 70.33 66.93 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 -0.95 2.01 0.28 -0.78 0.04 -1.25 -4.74 135.00 129.61 1req s PRO 543 Ca 0.33 1.71 -0.21 0.00 0.04 0.00 0.00 61.00 62.86 1req s PRO 543 Cb 0.07 -1.82 0.02 0.00 0.04 0.00 0.00 34.50 32.81 1req s PRO 543 CO -0.15 -1.92 0.73 1.14 0.04 0.00 0.00 177.00 176.84 1req s GLN 544 N -4.04 1.78 0.04 4.56 -2.07 -1.26 -1.14 119.66 117.52 1req s GLN 544 Ca 0.73 -0.99 0.04 0.00 -1.82 0.00 0.00 55.36 53.32 1req s GLN 544 Cb -0.28 0.60 -0.02 0.00 -1.09 0.00 0.00 33.01 32.22 1req s GLN 544 CO 0.47 -0.82 -0.13 0.54 -1.32 0.00 0.00 175.29 174.04 1req s VAL 545 N -3.86 1.01 -1.03 3.63 0.11 -0.75 -4.95 120.40 114.55 1req s VAL 545 Ca 0.11 -0.99 -0.13 0.00 -2.93 0.00 0.00 61.98 58.04 1req s VAL 545 Cb -0.06 -0.93 0.21 0.00 -1.53 0.00 0.00 36.38 34.07 1req s VAL 545 CO 0.07 -0.05 1.11 -1.61 -3.33 0.00 0.00 175.10 171.28 1req s GLU 546 N -1.18 3.93 1.97 1.54 2.02 -1.26 -2.66 118.70 123.06 1req s GLU 546 Ca 0.00 -2.64 0.00 0.00 0.02 0.00 0.00 54.97 52.35 1req s GLU 546 Cb -0.08 -4.71 0.00 0.00 0.10 0.00 0.00 34.13 29.44 1req s GLU 546 CO 0.01 -1.47 0.00 0.41 0.02 0.00 0.00 175.26 174.23 1req n GLY 547 N 3.82 -0.88 0.00 -1.39 0.00 0.74 -4.94 105.19 102.54 1req n GLY 547 Ca 0.24 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.16 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 1.19 3.87 -0.02 0.00 -1.26 -4.55 105.19 104.42 1req n GLY 548 Ca 0.00 -2.25 -0.29 0.00 0.00 0.00 0.00 46.02 43.47 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 -1.17 1.97 0.12 2.61 -4.23 -1.26 -4.76 115.64 108.92 1req s THR 549 Ca 0.00 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.30 1req s THR 549 Cb 0.00 -2.92 -0.06 0.00 1.34 0.00 0.00 72.50 70.86 1req s THR 549 CO 0.00 0.00 1.70 0.74 -0.54 0.00 0.00 174.62 176.52 1req h THR 550 N -1.52 0.80 -0.54 3.99 2.02 -1.99 -0.14 112.91 115.52 1req h THR 550 Ca -0.46 0.00 0.10 0.00 0.77 0.00 0.00 66.41 66.82 1req h THR 550 Cb 1.28 0.80 -0.08 0.00 -1.74 0.00 0.00 68.15 68.42 1req h THR 550 CO 0.50 0.00 0.11 0.00 0.37 0.00 0.00 175.52 176.50 1req h ALA 551 N 1.06 0.62 -0.76 6.16 0.00 -1.99 -1.68 119.26 122.67 1req h ALA 551 Ca 0.07 0.12 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 1req h ALA 551 Cb 0.15 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1req h ALA 551 CO -0.16 -0.30 0.27 0.93 0.00 0.00 0.00 179.25 179.99 1req h GLU 552 N 0.25 1.15 0.07 0.00 5.08 -1.40 -1.29 114.58 118.43 1req h GLU 552 Ca 0.28 -0.23 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1req h GLU 552 Cb 0.39 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 1req h GLU 552 CO -0.36 0.96 -0.17 0.82 -1.00 0.00 0.00 179.01 179.27 1req h ILE 553 N 1.11 0.61 -0.36 3.13 2.04 -1.03 -0.05 117.51 122.96 1req h ILE 553 Ca 0.25 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.16 1req h ILE 553 Cb 0.26 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 1req h ILE 553 CO -0.01 0.00 0.09 0.58 0.00 0.00 0.00 178.15 178.81 1req h VAL 554 N -0.31 0.85 -0.60 1.67 2.07 -1.21 0.50 116.25 119.22 1req h VAL 554 Ca 0.03 -0.08 -0.07 0.00 0.82 0.00 0.00 66.70 67.40 1req h VAL 554 Cb 0.34 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 1req h VAL 554 CO -0.11 0.04 0.09 1.05 0.02 0.00 0.00 177.57 178.66 1req h GLU 555 N 0.23 0.98 -0.32 1.57 4.11 -0.97 -0.15 114.58 120.03 1req h GLU 555 Ca 0.17 -0.25 -0.03 0.00 0.07 0.00 0.00 59.36 59.32 1req h GLU 555 Cb 0.17 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1req h GLU 555 CO -0.20 0.91 0.09 0.00 0.07 0.00 0.00 179.01 179.88 1req h ALA 556 N 1.17 0.43 0.19 1.06 0.00 -0.56 -1.48 119.26 120.06 1req h ALA 556 Ca 0.19 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1req h ALA 556 Cb 0.41 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1req h ALA 556 CO 0.01 0.08 -0.49 0.35 0.00 0.00 0.00 179.25 179.20 1req h PHE 557 N 0.37 -1.39 -0.98 0.00 3.57 0.54 -0.54 116.94 118.51 1req h PHE 557 Ca 0.10 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.72 1req h PHE 557 Cb 0.28 0.58 -0.07 0.00 2.79 0.00 0.00 35.95 39.53 1req h PHE 557 CO 0.01 -0.59 0.63 0.87 -2.23 0.00 0.00 178.31 177.00 1req h LYS 558 N -0.77 1.02 0.00 1.11 1.57 -0.97 -1.72 116.57 116.82 1req h LYS 558 Ca -0.01 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.65 1req h LYS 558 Cb 0.76 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1req h LYS 558 CO -0.23 0.68 -0.29 -0.22 -0.57 0.00 0.00 179.45 178.81 1req h LYS 559 N 1.05 0.00 -0.36 3.15 1.63 -1.05 -2.95 116.57 118.05 1req h LYS 559 Ca 0.45 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 60.18 1req h LYS 559 Cb 0.32 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.93 1req h LYS 559 CO -0.20 0.29 -0.07 0.66 -3.45 0.00 0.00 179.45 176.68 1req h SER 560 N 0.00 0.57 0.00 4.20 4.64 -0.13 -3.47 113.55 119.36 1req h SER 560 Ca -0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1req h SER 560 Cb 0.59 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1req h SER 560 CO 0.04 0.69 0.00 0.61 -0.87 0.00 0.00 176.83 177.30 1req n GLY 561 N -0.67 0.70 3.84 -0.77 0.00 -1.11 -5.02 105.19 102.15 1req n GLY 561 Ca 0.01 -0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.00 3.27 -0.84 4.61 0.00 -1.26 -4.98 121.76 120.56 1req s ALA 562 Ca 0.00 0.13 0.18 0.00 0.00 0.00 0.00 51.96 52.28 1req s ALA 562 Cb 0.00 -2.86 -0.20 0.00 0.00 0.00 0.00 23.12 20.06 1req s ALA 562 CO 0.00 0.29 0.77 1.04 0.00 0.00 0.00 175.76 177.85 1req n GLN 563 N -0.30 0.98 -4.42 0.00 6.02 -1.26 -4.91 117.38 113.49 1req n GLN 563 Ca 0.04 -0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.83 1req n GLN 563 Cb 0.53 -1.36 -0.14 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 -2.73 0.90 0.18 5.09 1.01 -1.26 -1.27 120.40 122.31 1req s VAL 564 Ca 0.07 -0.63 0.08 0.00 0.00 0.00 0.00 61.98 61.50 1req s VAL 564 Cb 0.14 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 1req s VAL 564 CO 0.75 0.15 -0.16 0.00 0.00 0.00 0.00 175.10 175.84 1req s ALA 565 N -0.46 1.94 -0.13 5.51 0.00 -1.08 -0.74 121.76 126.79 1req s ALA 565 Ca 0.03 -1.53 -0.00 0.00 0.00 0.00 0.00 51.96 50.46 1req s ALA 565 Cb -0.05 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 22.96 1req s ALA 565 CO 0.00 0.15 -0.10 0.34 0.00 0.00 0.00 175.76 176.14 1req s ASP 566 N -2.90 2.43 -0.21 0.00 2.15 0.45 -0.71 116.67 117.88 1req s ASP 566 Ca 0.17 -0.40 -0.29 0.00 0.43 0.00 0.00 52.55 52.47 1req s ASP 566 Cb -0.04 -1.00 0.01 0.00 -0.30 0.00 0.00 42.92 41.59 1req s ASP 566 CO 0.06 -0.09 1.03 -0.76 -0.17 0.00 0.00 175.17 175.24 1req s LEU 567 N 1.61 4.13 -0.17 -1.34 1.43 0.91 -1.15 118.68 124.09 1req s LEU 567 Ca 0.05 1.40 -0.01 0.00 -1.03 0.00 0.00 54.13 54.54 1req s LEU 567 Cb -0.13 -3.54 0.04 0.00 0.03 0.00 0.00 46.19 42.60 1req s LEU 567 CO -0.09 -0.63 -0.05 0.00 0.23 0.00 0.00 176.35 175.81 1req n SER 569 N 4.87 0.00 -4.75 0.00 2.88 -1.26 -2.13 113.62 113.23 1req n SER 569 Ca -0.12 -0.60 -0.23 0.00 -1.33 0.00 0.00 58.87 56.60 1req n SER 569 Cb 0.47 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 64.03 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 0.21 4.55 0.07 -3.46 1.04 -1.12 -4.65 113.70 110.34 1req s SER 570 Ca 0.00 -0.28 -0.19 0.00 0.48 0.00 0.00 55.95 55.96 1req s SER 570 Cb 0.00 -0.21 -0.11 0.00 0.10 0.00 0.00 66.02 65.81 1req s SER 570 CO 0.00 -1.71 1.46 0.00 0.98 0.00 0.00 173.24 173.97 1req h ALA 571 N -0.41 0.28 0.06 5.32 0.00 -1.90 -0.72 119.26 121.89 1req h ALA 571 Ca -0.38 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.30 1req h ALA 571 Cb 1.27 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1req h ALA 571 CO 0.43 0.05 -0.16 -0.22 0.00 0.00 0.00 179.25 179.35 1req h LYS 572 N 0.12 -0.29 -0.99 0.00 3.64 -1.96 -1.03 116.57 116.06 1req h LYS 572 Ca 0.05 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1req h LYS 572 Cb 0.49 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.32 1req h LYS 572 CO 0.02 -0.19 0.66 0.28 -2.27 0.00 0.00 179.45 177.94 1req h VAL 573 N -0.30 1.23 -0.86 2.00 2.07 -1.94 -2.47 116.25 115.98 1req h VAL 573 Ca 0.03 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 67.13 1req h VAL 573 Cb 0.33 -0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 29.85 1req h VAL 573 CO -0.11 0.24 0.56 1.88 0.02 0.00 0.00 177.57 180.16 1req h TYR 574 N 1.32 1.05 -0.16 1.57 0.05 -0.00 -2.13 116.97 118.67 1req h TYR 574 Ca 0.37 0.03 0.01 0.00 0.05 0.00 0.00 58.73 59.18 1req h TYR 574 Cb -0.11 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 37.27 1req h TYR 574 CO -0.00 0.61 0.11 0.00 -1.05 0.00 0.00 178.16 177.83 1req h ALA 575 N 1.35 1.91 0.00 3.88 0.00 -0.77 -0.21 119.26 125.41 1req h ALA 575 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1req h ALA 575 Cb -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1req h ALA 575 CO -0.11 0.08 -0.10 1.96 0.00 0.00 0.00 179.25 181.08 1req h GLN 576 N 0.20 0.00 -0.04 0.00 4.20 -1.16 -3.44 115.11 114.88 1req h GLN 576 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1req h GLN 576 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1req h GLN 576 CO -0.01 0.00 0.00 0.00 -0.67 0.00 0.00 178.83 178.15 1req n GLN 577 N -4.34 0.40 0.21 1.46 10.64 -0.86 -4.75 117.38 120.13 1req n GLN 577 Ca -0.01 -1.06 -0.16 0.00 -1.83 0.00 0.00 57.00 53.93 1req n GLN 577 Cb 0.05 -1.15 -0.09 0.00 -0.86 0.00 0.00 30.24 28.20 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 1.43 -1.03 0.95 2.61 0.00 -1.10 0.22 103.07 106.14 1req h GLY 578 Ca 0.00 0.53 -0.02 0.00 0.00 0.00 0.00 47.33 47.84 1req h GLY 578 CO 0.00 -0.32 0.17 -2.00 0.00 0.00 0.00 176.54 174.39 1req h LEU 579 N -0.82 0.53 -0.14 3.11 5.85 -1.86 0.26 115.31 122.23 1req h LEU 579 Ca -0.02 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.59 1req h LEU 579 Cb 0.76 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.61 1req h LEU 579 CO -0.14 0.54 -0.15 -0.08 -0.34 0.00 0.00 178.44 178.27 1req h GLU 580 N 0.49 -0.17 -0.16 1.25 4.81 -1.84 0.40 114.58 119.36 1req h GLU 580 Ca 0.13 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1req h GLU 580 Cb 0.16 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1req h GLU 580 CO -0.01 -0.11 0.09 0.28 -0.73 0.00 0.00 179.01 178.52 1req h VAL 581 N -0.17 1.09 -0.22 0.32 2.07 -0.37 -0.60 116.25 118.37 1req h VAL 581 Ca 0.10 -0.25 0.05 0.00 0.82 0.00 0.00 66.70 67.41 1req h VAL 581 Cb 0.32 0.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.01 1req h VAL 581 CO -0.25 0.09 -0.08 0.00 0.02 0.00 0.00 177.57 177.35 1req h ALA 582 N 0.99 0.12 -0.29 1.67 0.00 -0.10 0.11 119.26 121.76 1req h ALA 582 Ca 0.06 0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1req h ALA 582 Cb 0.06 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 1req h ALA 582 CO -0.01 -0.50 -0.15 0.87 0.00 0.00 0.00 179.25 179.47 1req h LYS 583 N -0.04 -0.11 -0.84 0.00 1.57 0.01 -0.91 116.57 116.26 1req h LYS 583 Ca 0.11 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1req h LYS 583 Cb 0.21 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 1req h LYS 583 CO -0.25 -0.07 0.51 0.00 -0.57 0.00 0.00 179.45 179.07 1req h ALA 584 N 1.10 1.32 -0.51 3.86 0.00 -0.78 0.34 119.26 124.59 1req h ALA 584 Ca 0.15 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1req h ALA 584 Cb 0.34 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1req h ALA 584 CO -0.36 0.59 -0.08 -0.07 0.00 0.00 0.00 179.25 179.33 1req h LEU 585 N 1.15 0.95 -0.42 0.00 3.38 -0.29 0.05 115.31 120.13 1req h LEU 585 Ca 0.30 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1req h LEU 585 Cb -0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1req h LEU 585 CO -0.06 1.07 0.22 0.11 0.09 0.00 0.00 178.44 179.88 1req h LYS 586 N 0.81 0.60 -0.67 1.13 6.56 -0.89 -2.47 116.57 121.63 1req h LYS 586 Ca 0.13 -0.08 0.14 0.00 -1.06 0.00 0.00 60.65 59.79 1req h LYS 586 Cb 0.64 -0.11 -0.12 0.00 -0.57 0.00 0.00 32.23 32.07 1req h LYS 586 CO 0.04 0.49 -0.03 0.00 -2.06 0.00 0.00 179.45 177.89 1req h ALA 587 N 1.07 0.63 0.00 3.86 0.00 0.18 -1.88 119.26 123.12 1req h ALA 587 Ca 0.15 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1req h ALA 587 Cb 0.07 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1req h ALA 587 CO -0.02 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 178.82 1req n ALA 588 N -2.91 2.32 0.00 0.00 0.00 -0.04 -4.85 120.51 115.04 1req n ALA 588 Ca 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1req n ALA 588 Cb 0.39 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 0.36 1.93 3.64 0.00 0.00 -0.70 -4.98 105.19 105.44 1req n GLY 589 Ca 0.05 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.50 1req n GLY 589 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1req n ALA 590 N -0.22 -0.03 0.20 4.61 0.00 -0.97 -4.82 120.51 119.27 1req n ALA 590 Ca 0.00 0.31 0.05 0.00 0.00 0.00 0.00 53.44 53.81 1req n ALA 590 Cb 0.00 -2.25 0.39 0.00 0.00 0.00 0.00 19.45 17.60 1req n ALA 590 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1req h LYS 591 N 7.99 0.00 -2.22 0.00 3.64 -1.54 -3.43 116.57 121.00 1req h LYS 591 Ca -0.41 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.90 1req h LYS 591 Cb 1.33 0.00 -0.21 0.00 -0.41 0.00 0.00 32.23 32.94 1req h LYS 591 CO 0.98 0.35 0.04 0.00 -2.27 0.00 0.00 179.45 178.55 1req s ALA 592 N -3.88 -1.55 -0.05 5.00 0.00 -1.25 -5.05 121.76 114.99 1req s ALA 592 Ca -0.01 1.62 0.05 0.00 0.00 0.00 0.00 51.96 53.62 1req s ALA 592 Cb 0.12 -0.80 -0.01 0.00 0.00 0.00 0.00 23.12 22.44 1req s ALA 592 CO 0.69 -0.31 -0.20 -0.51 0.00 0.00 0.00 175.76 175.43 1req s LEU 593 N -0.01 1.98 0.13 0.00 1.43 -1.26 -2.65 118.68 118.30 1req s LEU 593 Ca -0.03 -0.41 0.08 0.00 -1.03 0.00 0.00 54.13 52.75 1req s LEU 593 Cb -0.04 -1.11 -0.04 0.00 0.03 0.00 0.00 46.19 45.03 1req s LEU 593 CO 0.03 0.19 -0.12 -0.31 0.23 0.00 0.00 176.35 176.37 1req s TYR 594 N -0.08 2.66 -0.19 0.29 1.51 0.11 -1.40 117.35 120.26 1req s TYR 594 Ca -0.03 -0.20 -0.04 0.00 -1.01 0.00 0.00 57.07 55.80 1req s TYR 594 Cb -0.12 -1.38 -0.02 0.00 -0.11 0.00 0.00 41.96 40.34 1req s TYR 594 CO 0.02 0.44 -0.03 -1.17 -1.11 0.00 0.00 175.55 173.70 1req s LEU 595 N -2.35 3.07 -0.88 -1.29 2.96 -0.47 -0.06 118.68 119.66 1req s LEU 595 Ca 0.21 -0.27 -0.19 0.00 -0.22 0.00 0.00 54.13 53.66 1req s LEU 595 Cb -0.10 -1.77 0.12 0.00 0.50 0.00 0.00 46.19 44.94 1req s LEU 595 CO 0.13 0.06 1.08 -0.44 -1.32 0.00 0.00 176.35 175.86 1req s SER 596 N 1.02 6.55 0.00 3.68 0.01 -0.21 -1.04 113.70 123.71 1req s SER 596 Ca 0.01 -1.89 0.00 0.00 1.31 0.00 0.00 55.95 55.37 1req s SER 596 Cb -0.15 -2.39 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1req s SER 596 CO 0.01 -1.10 0.00 0.61 0.41 0.00 0.00 173.24 173.16 1req n GLY 597 N 5.43 -0.09 3.75 3.44 0.00 -0.94 -4.57 105.19 112.21 1req n GLY 597 Ca 0.19 -1.66 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 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 -1.10 3.47 0.39 4.61 0.00 -1.26 -4.66 121.76 123.22 1req s ALA 598 Ca 0.00 -1.04 0.08 0.00 0.00 0.00 0.00 51.96 51.00 1req s ALA 598 Cb 0.00 -1.36 0.81 0.00 0.00 0.00 0.00 23.12 22.57 1req s ALA 598 CO 0.00 0.73 1.96 0.74 0.00 0.00 0.00 175.76 179.20 1req h PHE 599 N 3.39 0.36 -0.06 0.00 0.04 -1.97 -2.76 116.94 115.93 1req h PHE 599 Ca -0.47 -0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.29 1req h PHE 599 Cb 1.16 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 39.20 1req h PHE 599 CO 0.61 0.36 0.24 0.87 -0.60 0.00 0.00 178.31 179.79 1req h LYS 600 N 0.35 0.00 0.00 1.51 6.56 -1.93 -2.17 116.57 120.89 1req h LYS 600 Ca 0.08 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.67 1req h LYS 600 Cb 0.22 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.88 1req h LYS 600 CO 0.00 0.00 -0.02 0.93 -2.06 0.00 0.00 179.45 178.31 1req h GLU 601 N 0.00 0.00 -0.35 3.15 5.08 -1.85 -2.85 114.58 117.75 1req h GLU 601 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1req h GLU 601 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1req h GLU 601 CO -0.00 0.02 0.00 1.19 -1.00 0.00 0.00 179.01 179.22 1req n PHE 602 N -3.70 0.44 0.00 4.33 3.01 -0.82 -3.18 117.46 117.54 1req n PHE 602 Ca -0.03 -0.21 0.00 0.00 1.01 0.00 0.00 57.45 58.22 1req n PHE 602 Cb 0.10 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 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 0.89 2.38 0.00 1.37 0.00 -1.08 -1.29 105.19 107.46 1req n GLY 603 Ca 0.10 0.38 0.12 0.00 0.00 0.00 0.00 46.02 46.62 1req n GLY 603 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1req n ASP 604 N 5.42 0.00 -1.28 1.61 8.00 -1.26 -1.87 116.55 127.16 1req n ASP 604 Ca 0.00 -0.96 0.12 0.00 0.71 0.00 0.00 54.79 54.66 1req n ASP 604 Cb 0.00 0.00 0.28 0.00 -0.02 0.00 0.00 41.12 41.38 1req n ASP 604 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1req n ASP 605 N -0.93 3.77 0.06 -2.24 8.00 -0.42 -4.76 116.55 120.03 1req n ASP 605 Ca 0.17 -2.00 -0.11 0.00 0.71 0.00 0.00 54.79 53.56 1req n ASP 605 Cb 0.08 -0.39 -0.05 0.00 -0.02 0.00 0.00 41.12 40.74 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 4.40 -0.13 0.31 2.24 0.00 -1.44 0.86 119.26 125.51 1req h ALA 606 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1req h ALA 606 Cb 0.99 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1req h ALA 606 CO 0.00 -0.60 -0.25 0.00 0.00 0.00 0.00 179.25 178.39 1req h ALA 607 N 0.77 -0.56 -0.43 0.00 0.00 -1.85 0.31 119.26 117.50 1req h ALA 607 Ca 0.04 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1req h ALA 607 Cb 0.23 0.35 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 1req h ALA 607 CO -0.10 -0.84 0.15 1.05 0.00 0.00 0.00 179.25 179.51 1req h GLU 608 N -0.57 0.31 -0.69 0.00 4.11 -1.88 -1.74 114.58 114.12 1req h GLU 608 Ca -0.02 -0.02 0.03 0.00 0.07 0.00 0.00 59.36 59.42 1req h GLU 608 Cb 0.51 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 1req h GLU 608 CO -0.02 0.21 0.43 0.00 0.07 0.00 0.00 179.01 179.70 1req h ALA 609 N 1.28 0.90 -0.82 1.06 0.00 -0.66 -2.97 119.26 118.04 1req h ALA 609 Ca 0.20 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.23 1req h ALA 609 Cb 0.19 -0.23 -0.09 0.00 0.00 0.00 0.00 17.79 17.65 1req h ALA 609 CO -0.20 0.21 0.39 0.93 0.00 0.00 0.00 179.25 180.58 1req h GLU 610 N 0.86 0.54 -0.21 0.00 3.07 0.55 -1.19 114.58 118.20 1req h GLU 610 Ca 0.27 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.09 1req h GLU 610 Cb 0.00 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 27.78 1req h GLU 610 CO -0.10 0.36 0.09 1.57 -1.40 0.00 0.00 179.01 179.53 1req h LYS 611 N 0.56 0.28 0.08 2.33 2.10 -1.34 -3.20 116.57 117.37 1req h LYS 611 Ca 0.45 -0.02 -0.29 0.00 -2.00 0.00 0.00 60.65 58.78 1req h LYS 611 Cb 0.65 -0.06 -0.02 0.00 -0.90 0.00 0.00 32.23 31.90 1req h LYS 611 CO -0.38 0.22 -1.53 -0.07 -2.00 0.00 0.00 179.45 175.69 1req h LEU 612 N 0.28 0.25 -9.08 7.07 3.38 -1.24 -3.46 115.31 112.51 1req h LEU 612 Ca 0.07 -0.38 -0.59 0.00 0.09 0.00 0.00 57.88 57.07 1req h LEU 612 Cb 0.04 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.63 1req h LEU 612 CO -0.01 1.32 0.42 -0.63 0.09 0.00 0.00 178.44 179.64 1req s ILE 613 N -2.62 4.86 -1.00 1.22 1.01 -0.76 -4.44 121.20 119.47 1req s ILE 613 Ca -0.08 1.57 0.27 0.00 0.00 0.00 0.00 60.65 62.41 1req s ILE 613 Cb 0.07 -4.11 0.13 0.00 0.01 0.00 0.00 42.46 38.56 1req s ILE 613 CO 0.84 -0.03 1.68 0.47 0.00 0.00 0.00 174.94 177.90 1req n ASP 614 N 5.68 0.24 0.00 3.58 9.92 -0.49 -4.87 116.55 130.60 1req n ASP 614 Ca 0.05 0.14 0.00 0.00 -0.53 0.00 0.00 54.79 54.45 1req n ASP 614 Cb 0.48 -0.14 0.00 0.00 -0.64 0.00 0.00 41.12 40.82 1req n ASP 614 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1req n GLY 615 N 1.50 1.71 3.41 0.44 0.00 -1.24 -5.02 105.19 106.00 1req n GLY 615 Ca 0.06 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 45.14 1req n GLY 615 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1req s ARG 616 N -2.00 1.49 -0.20 1.61 0.52 -1.26 -1.37 118.95 117.74 1req s ARG 616 Ca 0.00 -1.40 -0.05 0.00 -0.52 0.00 0.00 55.73 53.77 1req s ARG 616 Cb 0.00 -1.91 -0.02 0.00 0.52 0.00 0.00 34.95 33.54 1req s ARG 616 CO 0.00 0.43 -0.01 -0.51 0.02 0.00 0.00 175.30 175.23 1req s LEU 617 N -2.30 3.19 0.12 2.53 1.43 -0.21 -4.92 118.68 118.53 1req s LEU 617 Ca 0.17 -0.22 -0.24 0.00 -1.03 0.00 0.00 54.13 52.81 1req s LEU 617 Cb -0.09 -1.80 0.07 0.00 0.03 0.00 0.00 46.19 44.39 1req s LEU 617 CO 0.08 0.07 0.59 0.72 0.23 0.00 0.00 176.35 178.04 1req s PHE 618 N 0.98 -0.53 0.02 0.29 -0.71 -1.26 -2.22 117.98 114.55 1req s PHE 618 Ca 0.01 0.43 -0.30 0.00 -1.04 0.00 0.00 56.93 56.03 1req s PHE 618 Cb -0.14 0.51 -0.07 0.00 -1.21 0.00 0.00 43.02 42.10 1req s PHE 618 CO 0.01 -0.79 1.71 1.41 -1.34 0.00 0.00 175.22 176.22 1req s MET 619 N -3.30 4.18 0.00 1.99 -2.45 -1.26 -2.51 119.30 115.95 1req s MET 619 Ca -0.01 2.33 0.00 0.00 -1.25 0.00 0.00 55.69 56.76 1req s MET 619 Cb -0.01 -3.83 0.00 0.00 1.25 0.00 0.00 34.83 32.25 1req s MET 619 CO -0.09 -0.81 0.00 0.41 1.05 0.00 0.00 175.02 175.58 1req n GLY 620 N 4.13 0.32 3.60 2.11 0.00 -1.26 -5.07 105.19 109.02 1req n GLY 620 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.17 -2.94 1.61 3.85 -1.04 -4.78 117.12 111.65 1req n MET 621 Ca 0.00 0.02 -0.43 0.00 -1.00 0.00 0.00 57.70 56.29 1req n MET 621 Cb 0.00 -2.23 -0.05 0.00 -1.05 0.00 0.00 33.22 29.89 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 -2.24 6.49 0.13 3.17 -1.08 -1.26 -4.11 116.67 117.77 1req s ASP 622 Ca 0.66 0.16 0.08 0.00 -0.52 0.00 0.00 52.55 52.93 1req s ASP 622 Cb -0.25 -2.40 -0.19 0.00 -1.46 0.00 0.00 42.92 38.62 1req s ASP 622 CO 0.58 -0.84 1.27 -0.37 0.52 0.00 0.00 175.17 176.34 1req h VAL 623 N 5.87 1.64 0.03 1.11 -1.51 -1.55 -2.87 116.25 118.97 1req h VAL 623 Ca -0.25 -3.33 -0.00 0.00 -1.23 0.00 0.00 66.70 61.89 1req h VAL 623 Cb 1.09 2.81 0.00 0.00 -2.13 0.00 0.00 31.29 33.06 1req h VAL 623 CO 0.94 0.94 -0.01 0.58 -1.23 0.00 0.00 177.57 178.78 1req h VAL 624 N 0.00 1.11 0.35 7.19 2.07 -1.91 0.07 116.25 125.13 1req h VAL 624 Ca -0.02 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 1req h VAL 624 Cb 1.75 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.92 1req h VAL 624 CO 0.12 0.11 -0.17 -0.78 0.02 0.00 0.00 177.57 176.87 1req h ASP 625 N -0.22 -0.40 -0.19 0.57 3.58 -1.91 -1.06 116.42 116.78 1req h ASP 625 Ca -0.00 -0.01 0.04 0.00 0.42 0.00 0.00 57.03 57.47 1req h ASP 625 Cb 0.21 0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.33 1req h ASP 625 CO 0.01 -0.25 -0.02 0.74 -2.88 0.00 0.00 179.24 176.83 1req h THR 626 N -0.51 0.84 -0.14 2.25 2.02 -1.51 -1.52 112.91 114.33 1req h THR 626 Ca -0.05 -0.01 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 1req h THR 626 Cb 0.39 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1req h THR 626 CO 0.08 0.01 0.05 -0.07 0.37 0.00 0.00 175.52 175.96 1req h LEU 627 N 0.03 0.20 -0.67 2.58 3.38 -0.76 -0.45 115.31 119.62 1req h LEU 627 Ca 0.09 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 1req h LEU 627 Cb 0.13 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1req h LEU 627 CO -0.18 0.31 -0.14 0.77 0.09 0.00 0.00 178.44 179.30 1req h SER 628 N 0.07 0.89 -0.89 -0.43 4.64 -1.15 -1.22 113.55 115.45 1req h SER 628 Ca 0.05 -0.29 0.01 0.00 -0.47 0.00 0.00 61.79 61.08 1req h SER 628 Cb 0.18 -0.24 -0.04 0.00 -0.31 0.00 0.00 62.40 61.99 1req h SER 628 CO -0.00 1.03 0.59 -1.28 -0.87 0.00 0.00 176.83 176.29 1req h SER 629 N 0.79 1.02 -0.67 4.97 0.87 -1.13 0.67 113.55 120.06 1req h SER 629 Ca 0.12 -0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.63 1req h SER 629 Cb 0.67 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 62.34 1req h SER 629 CO 0.05 0.74 0.35 0.74 -0.53 0.00 0.00 176.83 178.17 1req h THR 630 N 1.21 1.22 -0.50 2.23 2.02 -0.91 0.10 112.91 118.28 1req h THR 630 Ca 0.33 -0.60 -0.07 0.00 0.77 0.00 0.00 66.41 66.84 1req h THR 630 Cb -0.14 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 66.57 1req h THR 630 CO -0.07 0.25 0.04 -0.07 0.37 0.00 0.00 175.52 176.05 1req h LEU 631 N 0.98 0.82 -0.01 2.58 3.38 -0.41 -1.45 115.31 121.21 1req h LEU 631 Ca 0.24 -0.28 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1req h LEU 631 Cb 0.08 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1req h LEU 631 CO -0.03 0.90 -0.11 0.44 0.09 0.00 0.00 178.44 179.73 1req h ASP 632 N 0.72 -0.32 -0.98 -0.43 3.32 0.49 -2.45 116.42 116.77 1req h ASP 632 Ca 0.15 0.05 0.17 0.00 0.02 0.00 0.00 57.03 57.42 1req h ASP 632 Cb 0.45 0.14 -0.09 0.00 0.22 0.00 0.00 39.33 40.05 1req h ASP 632 CO 0.02 -0.16 0.61 0.40 -1.72 0.00 0.00 179.24 178.39 1req h ILE 633 N -0.18 0.76 0.00 0.35 2.04 -0.83 0.65 117.51 120.29 1req h ILE 633 Ca 0.04 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1req h ILE 633 Cb 0.24 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 1req h ILE 633 CO -0.12 0.14 0.00 0.18 0.00 0.00 0.00 178.15 178.35 1req n LEU 634 N -4.68 0.00 -2.41 1.44 4.77 -0.56 -4.90 117.00 110.66 1req n LEU 634 Ca 0.21 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 56.06 1req n LEU 634 Cb 0.54 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.68 1req n LEU 634 CO 0.24 0.00 0.13 0.61 -1.33 0.00 0.00 177.39 177.05 1req n GLY 635 N 0.74 0.02 3.85 -0.72 0.00 0.22 -5.01 105.19 104.29 1req n GLY 635 Ca 0.12 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.20 5.34 0.83 1.61 1.01 -0.95 -5.05 120.40 119.99 1req s VAL 636 Ca 0.29 0.43 -0.14 0.00 0.00 0.00 0.00 61.98 62.55 1req s VAL 636 Cb -0.13 -3.51 0.03 0.00 0.00 0.00 0.00 36.38 32.77 1req s VAL 636 CO 0.44 0.59 0.76 0.00 0.00 0.00 0.00 175.10 176.89 1req n ALA 637 N 2.08 -1.27 0.00 5.51 0.00 -1.26 -4.48 120.51 121.08 1req n ALA 637 Ca -0.17 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1req n ALA 637 Cb 0.54 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 18.00 1req n ALA 637 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67