#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wn8 h TRP 26 N 0.00 0.00 -0.21 -0.32 5.08 -2.05 -3.05 115.95 115.40 2wn8 h TRP 26 Ca 0.00 0.00 -0.21 0.00 1.08 0.00 0.00 58.89 59.76 2wn8 h TRP 26 Cb 0.00 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.17 2wn8 h TRP 26 CO 0.00 0.18 -0.68 0.93 -1.28 0.00 0.00 178.44 177.60 2wn8 h GLU 27 N 0.00 0.82 -0.56 0.12 5.08 -2.04 -1.40 114.58 116.60 2wn8 h GLU 27 Ca -0.00 -0.60 -0.06 0.00 -1.00 0.00 0.00 59.36 57.70 2wn8 h GLU 27 Cb 0.61 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 2wn8 h GLU 27 CO 0.02 1.22 0.12 -0.09 -1.00 0.00 0.00 179.01 179.29 2wn8 h ARG 28 N 0.59 0.91 -0.49 2.33 2.43 -1.96 -0.29 114.38 117.91 2wn8 h ARG 28 Ca -0.02 -0.23 -0.10 0.00 -0.81 0.00 0.00 59.98 58.81 2wn8 h ARG 28 Cb 1.30 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.72 2wn8 h ARG 28 CO 0.14 0.86 -0.11 0.87 -1.51 0.00 0.00 179.97 180.23 2wn8 h LYS 29 N 0.81 0.93 -0.80 0.20 1.79 -1.59 -2.50 116.57 115.41 2wn8 h LYS 29 Ca 0.17 -0.35 -0.02 0.00 -2.18 0.00 0.00 60.65 58.28 2wn8 h LYS 29 Cb 0.37 -0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 30.92 2wn8 h LYS 29 CO 0.00 1.01 0.42 1.49 -1.08 0.00 0.00 179.45 181.29 2wn8 h GLU 30 N 0.78 1.12 -0.50 3.15 4.57 -0.99 -0.31 114.58 122.40 2wn8 h GLU 30 Ca 0.12 -0.13 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 2wn8 h GLU 30 Cb 0.66 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.01 2wn8 h GLU 30 CO 0.05 0.83 0.22 0.00 -1.18 0.00 0.00 179.01 178.92 2wn8 h ALA 31 N 1.34 0.65 -0.82 2.92 0.00 -1.00 -0.21 119.26 122.14 2wn8 h ALA 31 Ca 0.28 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.13 2wn8 h ALA 31 Cb 0.05 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 17.58 2wn8 h ALA 31 CO -0.04 0.24 0.48 1.49 0.00 0.00 0.00 179.25 181.42 2wn8 h GLU 32 N 0.67 0.82 -0.54 0.00 4.81 -0.94 -1.36 114.58 118.03 2wn8 h GLU 32 Ca 0.17 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.28 2wn8 h GLU 32 Cb 0.17 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 2wn8 h GLU 32 CO -0.02 0.54 0.08 -0.09 -0.73 0.00 0.00 179.01 178.80 2wn8 h ARG 33 N 0.84 0.90 -0.80 1.92 2.43 -0.70 -3.02 114.38 115.95 2wn8 h ARG 33 Ca 0.38 -0.24 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 2wn8 h ARG 33 Cb 0.29 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 2wn8 h ARG 33 CO -0.22 0.87 0.41 0.82 -1.51 0.00 0.00 179.97 180.35 2wn8 h ILE 34 N 0.79 1.24 -0.36 1.20 1.08 -0.33 -2.44 117.51 118.69 2wn8 h ILE 34 Ca 0.16 -0.65 -0.04 0.00 -0.39 0.00 0.00 64.86 63.95 2wn8 h ILE 34 Cb 0.41 0.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.33 2wn8 h ILE 34 CO 0.01 0.28 0.06 -0.08 -0.69 0.00 0.00 178.15 177.73 2wn8 h GLU 35 N 1.13 0.54 0.00 2.37 4.81 -1.18 -1.31 114.58 120.94 2wn8 h GLU 35 Ca 0.28 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2wn8 h GLU 35 Cb 0.07 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.36 2wn8 h GLU 35 CO -0.04 0.52 0.00 1.96 -0.73 0.00 0.00 179.01 180.72 2wn8 h GLN 36 N 0.53 0.00 0.00 1.92 1.08 -1.32 -1.64 115.11 115.68 2wn8 h GLN 36 Ca 0.12 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.27 2wn8 h GLN 36 Cb 0.25 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 2wn8 h GLN 36 CO 0.00 0.00 -0.22 0.87 -0.95 0.00 0.00 178.83 178.53 2wn8 h LYS 37 N 0.00 0.00 -6.85 1.46 1.57 -1.10 -3.46 116.57 108.20 2wn8 h LYS 37 Ca 0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 2wn8 h LYS 37 Cb 0.32 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 2wn8 h LYS 37 CO 0.00 0.22 0.21 -0.51 -0.57 0.00 0.00 179.45 178.81 2wn8 s LEU 38 N -7.41 4.08 0.81 2.94 1.43 -0.62 -5.06 118.68 114.85 2wn8 s LEU 38 Ca -0.02 1.50 -0.12 0.00 -1.03 0.00 0.00 54.13 54.46 2wn8 s LEU 38 Cb 0.13 -4.18 0.08 0.00 0.03 0.00 0.00 46.19 42.25 2wn8 s LEU 38 CO 0.64 -0.22 1.17 -1.61 0.23 0.00 0.00 176.35 176.56 2wn8 s GLU 39 N -2.84 1.70 0.32 1.70 2.02 -1.26 -4.74 118.70 115.60 2wn8 s GLU 39 Ca 0.55 1.61 0.04 0.00 0.02 0.00 0.00 54.97 57.18 2wn8 s GLU 39 Cb -0.11 -1.80 0.56 0.00 0.10 0.00 0.00 34.13 32.88 2wn8 s GLU 39 CO 0.17 -2.13 1.85 0.00 0.02 0.00 0.00 175.26 175.17 2wn8 h ARG 40 N -1.03 0.54 -0.34 1.61 3.08 -1.97 0.13 114.38 116.40 2wn8 h ARG 40 Ca -0.45 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 59.42 2wn8 h ARG 40 Cb 1.28 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.24 2wn8 h ARG 40 CO 0.47 0.59 -0.02 0.66 -1.07 0.00 0.00 179.97 180.59 2wn8 h SER 41 N 0.52 0.51 -0.04 7.04 4.64 -1.99 0.29 113.55 124.52 2wn8 h SER 41 Ca 0.11 -0.11 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 2wn8 h SER 41 Cb 0.37 -0.13 0.02 0.00 -0.31 0.00 0.00 62.40 62.34 2wn8 h SER 41 CO 0.01 0.60 -0.98 -0.33 -0.87 0.00 0.00 176.83 175.27 2wn8 h GLU 42 N 0.52 0.73 -0.87 4.77 5.08 -1.55 -2.19 114.58 121.06 2wn8 h GLU 42 Ca 0.11 -0.74 0.06 0.00 -1.00 0.00 0.00 59.36 57.79 2wn8 h GLU 42 Cb 0.37 0.20 -0.06 0.00 0.50 0.00 0.00 28.75 29.76 2wn8 h GLU 42 CO 0.01 1.32 0.55 0.87 -1.00 0.00 0.00 179.01 180.76 2wn8 h LYS 43 N 0.44 0.98 -0.70 2.33 1.57 -0.58 -1.05 116.57 119.56 2wn8 h LYS 43 Ca -0.11 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 2wn8 h LYS 43 Cb 1.63 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 33.68 2wn8 h LYS 43 CO 0.19 0.65 0.41 1.49 -0.57 0.00 0.00 179.45 181.63 2wn8 h GLU 44 N 1.01 0.96 -0.52 3.15 4.81 -0.83 -1.07 114.58 122.09 2wn8 h GLU 44 Ca 0.37 -0.09 -0.11 0.00 -0.13 0.00 0.00 59.36 59.40 2wn8 h GLU 44 Cb 0.13 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 2wn8 h GLU 44 CO -0.16 0.69 -0.10 0.00 -0.73 0.00 0.00 179.01 178.71 2wn8 h ALA 45 N 1.21 0.84 -0.69 2.92 0.00 -1.02 -2.72 119.26 119.81 2wn8 h ALA 45 Ca 0.25 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2wn8 h ALA 45 Cb -0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2wn8 h ALA 45 CO -0.05 0.65 0.17 1.25 0.00 0.00 0.00 179.25 181.28 2wn8 h LEU 46 N 0.86 1.04 -0.97 0.00 6.46 -0.79 -1.64 115.31 120.27 2wn8 h LEU 46 Ca 0.14 -0.23 -0.03 0.00 -0.12 0.00 0.00 57.88 57.63 2wn8 h LEU 46 Cb 0.64 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 40.27 2wn8 h LEU 46 CO 0.04 1.00 0.34 -0.33 -0.62 0.00 0.00 178.44 178.88 2wn8 h GLU 47 N 1.03 1.08 -0.68 1.25 4.39 -1.13 -0.15 114.58 120.37 2wn8 h GLU 47 Ca 0.22 -0.16 -0.07 0.00 0.34 0.00 0.00 59.36 59.68 2wn8 h GLU 47 Cb 0.37 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.80 2wn8 h GLU 47 CO 0.00 0.85 0.14 0.77 -1.16 0.00 0.00 179.01 179.61 2wn8 h SER 48 N 1.07 1.05 -0.76 1.42 0.02 -1.25 -2.82 113.55 112.28 2wn8 h SER 48 Ca 0.26 -0.25 -0.04 0.00 -0.84 0.00 0.00 61.79 60.92 2wn8 h SER 48 Cb 0.14 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.36 2wn8 h SER 48 CO -0.03 1.03 0.31 0.22 -1.14 0.00 0.00 176.83 177.22 2wn8 h TYR 49 N 1.03 1.15 -0.99 3.45 3.20 -0.75 -1.88 116.97 122.18 2wn8 h TYR 49 Ca 0.21 -0.08 0.07 0.00 3.14 0.00 0.00 58.73 62.07 2wn8 h TYR 49 Cb 0.41 -0.35 -0.07 0.00 1.54 0.00 0.00 36.73 38.26 2wn8 h TYR 49 CO 0.03 0.87 0.64 0.87 -1.64 0.00 0.00 178.16 178.93 2wn8 h LYS 50 N 1.10 1.11 -0.07 1.82 1.57 -0.86 -2.99 116.57 118.25 2wn8 h LYS 50 Ca 0.26 -0.07 -0.16 0.00 -1.87 0.00 0.00 60.65 58.81 2wn8 h LYS 50 Cb 0.20 -0.25 0.01 0.00 0.08 0.00 0.00 32.23 32.27 2wn8 h LYS 50 CO -0.02 0.73 -0.57 0.87 -0.57 0.00 0.00 179.45 179.89 2wn8 h LYS 51 N 1.14 0.51 -2.12 3.15 1.57 -1.23 -3.44 116.57 116.14 2wn8 h LYS 51 Ca 0.43 -0.46 -0.21 0.00 -1.87 0.00 0.00 60.65 58.55 2wn8 h LYS 51 Cb 0.19 0.11 -0.32 0.00 0.08 0.00 0.00 32.23 32.29 2wn8 h LYS 51 CO -0.17 1.09 -0.53 0.34 -0.57 0.00 0.00 179.45 179.61 2wn8 s ASP 52 N -6.75 0.62 -0.02 0.86 2.15 -0.74 -5.02 116.67 107.77 2wn8 s ASP 52 Ca -0.13 0.09 0.21 0.00 0.43 0.00 0.00 52.55 53.15 2wn8 s ASP 52 Cb 0.05 0.87 -0.31 0.00 -0.30 0.00 0.00 42.92 43.23 2wn8 s ASP 52 CO 0.83 -0.31 0.56 -1.54 -0.17 0.00 0.00 175.17 174.54 2wn8 n SER 53 N 5.35 0.29 0.01 -0.34 3.41 -1.14 -4.40 113.62 116.80 2wn8 n SER 53 Ca -0.04 -0.21 -0.13 0.00 -0.26 0.00 0.00 58.87 58.23 2wn8 n SER 53 Cb 0.50 1.77 -0.09 0.00 -0.26 0.00 0.00 64.21 66.14 2wn8 n SER 53 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2wn8 h VAL 54 N 0.00 1.23 0.01 -3.33 2.07 -1.95 -2.12 116.25 112.15 2wn8 h VAL 54 Ca 0.00 -0.67 -0.23 0.00 0.82 0.00 0.00 66.70 66.62 2wn8 h VAL 54 Cb 0.88 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 2wn8 h VAL 54 CO 0.00 0.17 -0.96 -0.33 0.02 0.00 0.00 177.57 176.48 2wn8 h GLU 55 N -0.29 0.39 -0.52 1.57 4.39 -2.00 -1.76 114.58 116.37 2wn8 h GLU 55 Ca -0.00 -0.44 -0.12 0.00 0.34 0.00 0.00 59.36 59.14 2wn8 h GLU 55 Cb 0.29 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.05 2wn8 h GLU 55 CO 0.00 1.11 -0.14 0.97 -1.16 0.00 0.00 179.01 179.79 2wn8 h ILE 56 N 0.22 1.27 -0.37 3.13 6.09 -1.80 -1.29 117.51 124.75 2wn8 h ILE 56 Ca -0.08 -1.30 -0.07 0.00 -1.37 0.00 0.00 64.86 62.04 2wn8 h ILE 56 Cb 1.60 1.03 -0.01 0.00 0.47 0.00 0.00 36.82 39.91 2wn8 h ILE 56 CO 0.16 0.46 -0.04 0.28 -3.07 0.00 0.00 178.15 175.94 2wn8 h SER 57 N 0.88 0.68 -0.28 2.19 0.02 -1.34 0.25 113.55 115.95 2wn8 h SER 57 Ca 0.13 -0.34 0.05 0.00 -0.84 0.00 0.00 61.79 60.79 2wn8 h SER 57 Cb 0.72 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 63.03 2wn8 h SER 57 CO 0.05 0.86 -0.00 0.50 -1.14 0.00 0.00 176.83 177.10 2wn8 h LYS 58 N 0.49 0.08 -0.94 3.45 3.64 -1.33 -2.50 116.57 119.46 2wn8 h LYS 58 Ca 0.10 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2wn8 h LYS 58 Cb 0.53 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.28 2wn8 h LYS 58 CO 0.03 0.05 0.62 -0.92 -2.27 0.00 0.00 179.45 176.96 2wn8 h TYR 59 N 0.08 1.14 0.00 1.91 3.20 -0.90 -2.30 116.97 120.09 2wn8 h TYR 59 Ca 0.13 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2wn8 h TYR 59 Cb 0.18 -0.38 0.00 0.00 1.54 0.00 0.00 36.73 38.07 2wn8 h TYR 59 CO -0.22 0.64 0.00 0.66 -1.64 0.00 0.00 178.16 177.61 2wn8 h SER 60 N 1.16 0.00 0.28 -2.11 4.64 -0.50 -1.54 113.55 115.48 2wn8 h SER 60 Ca 0.38 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.37 2wn8 h SER 60 Cb 0.05 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.18 2wn8 h SER 60 CO -0.12 0.00 -1.47 1.56 -0.87 0.00 0.00 176.83 175.92 2wn8 h GLN 61 N 0.00 0.54 0.00 4.77 4.20 -1.21 -3.33 115.11 120.07 2wn8 h GLN 61 Ca 0.00 -0.91 0.00 0.00 0.06 0.00 0.00 58.65 57.80 2wn8 h GLN 61 Cb 0.34 0.34 0.00 0.00 0.30 0.00 0.00 27.48 28.46 2wn8 h GLN 61 CO 0.00 1.44 0.00 0.25 -0.67 0.00 0.00 178.83 179.85 2wn8 n THR 62 N -3.71 0.70 -0.05 -0.54 -2.24 -1.18 -4.78 114.28 102.47 2wn8 n THR 62 Ca -0.16 -0.75 0.21 0.00 -2.27 0.00 0.00 64.05 61.08 2wn8 n THR 62 Cb 1.10 0.68 0.68 0.00 -2.10 0.00 0.00 70.33 70.69 2wn8 n THR 62 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 2wn8 h ARG 63 N 0.00 0.04 -0.01 -0.78 0.11 -1.50 -2.74 114.38 109.50 2wn8 h ARG 63 Ca 0.00 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2wn8 h ARG 63 Cb 0.52 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.59 2wn8 h ARG 63 CO 0.00 0.02 0.00 0.27 0.10 0.00 0.00 179.97 180.36 2wn8 n ASN 64 N -4.37 0.89 -0.56 0.08 6.94 -1.26 -3.57 115.26 113.42 2wn8 n ASN 64 Ca 0.12 -1.30 0.13 0.00 -0.02 0.00 0.00 54.58 53.51 2wn8 n ASN 64 Cb 0.67 -0.00 0.35 0.00 -2.36 0.00 0.00 39.78 38.44 2wn8 n ASN 64 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2wn8 n TYR 65 N -0.30 0.00 -2.53 -2.53 4.01 -1.03 -2.59 117.16 112.18 2wn8 n TYR 65 Ca 0.21 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.72 2wn8 n TYR 65 Cb 0.25 -0.02 0.08 0.00 -0.31 0.00 0.00 39.34 39.34 2wn8 n TYR 65 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2wn8 s PHE 66 N -2.13 2.20 0.75 -0.72 0.08 -1.23 -3.21 117.98 113.72 2wn8 s PHE 66 Ca 0.32 -0.08 -0.14 0.00 0.12 0.00 0.00 56.93 57.15 2wn8 s PHE 66 Cb 0.20 -2.97 0.05 0.00 -0.57 0.00 0.00 43.02 39.73 2wn8 s PHE 66 CO 0.38 -1.41 1.16 0.71 -0.10 0.00 0.00 175.22 175.96 2wn8 s TYR 67 N -3.05 2.18 0.33 0.36 2.02 -1.26 -2.03 117.35 115.90 2wn8 s TYR 67 Ca 0.63 1.62 0.01 0.00 -0.37 0.00 0.00 57.07 58.96 2wn8 s TYR 67 Cb -0.08 -3.33 0.58 0.00 -0.40 0.00 0.00 41.96 38.73 2wn8 s TYR 67 CO 0.43 -2.33 1.97 0.38 -1.57 0.00 0.00 175.55 174.43 2wn8 h ASP 68 N -0.56 0.74 1.27 2.29 2.03 -1.96 -0.29 116.42 119.93 2wn8 h ASP 68 Ca -0.46 -0.04 -0.10 0.00 -0.73 0.00 0.00 57.03 55.69 2wn8 h ASP 68 Cb 1.27 -0.19 -0.01 0.00 -0.83 0.00 0.00 39.33 39.57 2wn8 h ASP 68 CO 0.50 0.58 -0.49 0.10 -1.03 0.00 0.00 179.24 178.89 2wn8 h TYR 69 N 0.85 0.00 -0.25 4.15 -0.00 -1.97 -2.32 116.97 117.42 2wn8 h TYR 69 Ca 0.22 0.00 -0.19 0.00 0.00 0.00 0.00 58.73 58.76 2wn8 h TYR 69 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.72 2wn8 h TYR 69 CO 0.00 0.49 -0.58 0.37 -0.00 0.00 0.00 178.16 178.45 2wn8 h GLN 70 N 0.00 0.81 0.12 0.10 4.15 -1.69 -1.71 115.11 116.90 2wn8 h GLN 70 Ca -0.00 -0.53 -0.01 0.00 0.77 0.00 0.00 58.65 58.88 2wn8 h GLN 70 Cb 1.26 0.07 0.00 0.00 0.21 0.00 0.00 27.48 29.02 2wn8 h GLN 70 CO 0.06 1.16 -0.06 0.82 -1.93 0.00 0.00 178.83 178.89 2wn8 h ILE 71 N 0.61 0.95 -0.68 2.39 2.04 -1.05 -2.84 117.51 118.93 2wn8 h ILE 71 Ca 0.00 -0.25 0.06 0.00 1.00 0.00 0.00 64.86 65.67 2wn8 h ILE 71 Cb 1.18 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 38.33 2wn8 h ILE 71 CO 0.12 0.06 0.45 -0.08 0.00 0.00 0.00 178.15 178.70 2wn8 h GLU 72 N -0.28 0.68 0.00 2.37 4.81 -1.37 -2.56 114.58 118.24 2wn8 h GLU 72 Ca -0.02 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.08 2wn8 h GLU 72 Cb 0.22 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 2wn8 h GLU 72 CO 0.03 0.45 -0.46 0.00 -0.73 0.00 0.00 179.01 178.30 2wn8 h ALA 73 N 1.63 0.77 -2.51 2.92 0.00 -1.23 -3.47 119.26 117.37 2wn8 h ALA 73 Ca 0.29 -0.42 -0.55 0.00 0.00 0.00 0.00 54.91 54.23 2wn8 h ALA 73 Cb 0.24 -0.07 0.07 0.00 0.00 0.00 0.00 17.79 18.03 2wn8 h ALA 73 CO -0.09 0.58 0.88 -1.71 0.00 0.00 0.00 179.25 178.90 2wn8 n ASN 74 N -3.32 3.55 0.31 0.00 2.85 -0.96 -4.86 115.26 112.82 2wn8 n ASN 74 Ca 0.01 1.09 0.19 0.00 -0.11 0.00 0.00 54.58 55.76 2wn8 n ASN 74 Cb 0.66 -1.51 1.03 0.00 1.24 0.00 0.00 39.78 41.19 2wn8 n ASN 74 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 2wn8 h SER 75 N 5.89 0.00 0.04 1.20 4.64 -1.90 -1.78 113.55 121.64 2wn8 h SER 75 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2wn8 h SER 75 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2wn8 h SER 75 CO 0.89 0.00 -0.36 0.54 -0.87 0.00 0.00 176.83 177.03 2wn8 n ARG 76 N -3.45 1.25 -0.17 4.77 1.74 -1.26 -4.53 116.66 115.02 2wn8 n ARG 76 Ca -0.02 -0.97 -0.10 0.00 -0.77 0.00 0.00 57.85 55.99 2wn8 n ARG 76 Cb 0.13 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.09 2wn8 n ARG 76 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2wn8 h GLU 77 N 2.37 0.83 -0.63 5.56 4.57 -1.60 -1.16 114.58 124.52 2wn8 h GLU 77 Ca 0.00 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 57.91 2wn8 h GLU 77 Cb 0.71 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.19 2wn8 h GLU 77 CO 0.00 0.87 0.33 0.87 -1.18 0.00 0.00 179.01 179.90 2wn8 h LYS 78 N 0.69 0.88 -0.61 1.92 1.57 -1.80 -1.46 116.57 117.76 2wn8 h LYS 78 Ca 0.14 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2wn8 h LYS 78 Cb 0.48 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 2wn8 h LYS 78 CO 0.02 0.68 0.40 1.49 -0.57 0.00 0.00 179.45 181.47 2wn8 h GLU 79 N 0.85 0.81 -0.01 3.15 4.81 -1.80 -1.89 114.58 120.51 2wn8 h GLU 79 Ca 0.22 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.41 2wn8 h GLU 79 Cb 0.06 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 2wn8 h GLU 79 CO -0.03 0.54 -0.06 -0.92 -0.73 0.00 0.00 179.01 177.81 2wn8 h TYR 80 N 0.83 -0.15 -0.54 0.92 3.20 -0.92 -1.48 116.97 118.84 2wn8 h TYR 80 Ca 0.22 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.10 2wn8 h TYR 80 Cb -0.09 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 2wn8 h TYR 80 CO -0.03 -0.09 0.34 0.87 -1.64 0.00 0.00 178.16 177.60 2wn8 h LYS 81 N -0.10 0.72 -0.51 1.82 1.57 -1.11 0.03 116.57 119.00 2wn8 h LYS 81 Ca 0.03 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.65 2wn8 h LYS 81 Cb 0.14 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 2wn8 h LYS 81 CO -0.07 0.51 -0.10 0.93 -0.57 0.00 0.00 179.45 180.15 2wn8 h GLU 82 N 0.73 0.97 -0.55 3.15 4.39 -1.26 -1.82 114.58 120.19 2wn8 h GLU 82 Ca 0.20 -0.36 -0.10 0.00 0.34 0.00 0.00 59.36 59.44 2wn8 h GLU 82 Cb -0.04 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.53 2wn8 h GLU 82 CO -0.04 1.03 -0.03 1.25 -1.16 0.00 0.00 179.01 180.06 2wn8 h LEU 83 N 0.83 0.98 -0.60 1.33 5.85 -1.14 0.13 115.31 122.70 2wn8 h LEU 83 Ca 0.13 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.57 2wn8 h LEU 83 Cb 0.66 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 2wn8 h LEU 83 CO 0.05 1.06 0.35 -0.09 -0.34 0.00 0.00 178.44 179.47 2wn8 h ARG 84 N 0.87 0.67 -0.41 1.25 2.43 -0.84 -1.75 114.38 116.61 2wn8 h ARG 84 Ca 0.15 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 2wn8 h ARG 84 Cb 0.58 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 2wn8 h ARG 84 CO 0.03 0.44 -0.08 -0.91 -1.51 0.00 0.00 179.97 177.95 2wn8 h ASN 85 N 0.69 0.77 -0.34 -3.80 2.35 -1.09 -2.91 115.58 111.26 2wn8 h ASN 85 Ca 0.25 -0.35 0.07 0.00 -0.55 0.00 0.00 56.30 55.71 2wn8 h ASN 85 Cb 0.05 -0.21 -0.07 0.00 0.05 0.00 0.00 38.32 38.14 2wn8 h ASN 85 CO -0.12 0.94 -0.12 0.00 -1.65 0.00 0.00 177.43 176.48 2wn8 h ALA 86 N 0.86 0.16 -0.71 -0.83 0.00 -0.47 -2.40 119.26 115.86 2wn8 h ALA 86 Ca 0.11 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.19 2wn8 h ALA 86 Cb 0.59 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 2wn8 h ALA 86 CO 0.04 -0.50 0.42 0.82 0.00 0.00 0.00 179.25 180.02 2wn8 h ILE 87 N -0.06 1.02 0.00 0.00 2.04 -1.28 -1.68 117.51 117.55 2wn8 h ILE 87 Ca 0.17 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.76 2wn8 h ILE 87 Cb 0.31 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 2wn8 h ILE 87 CO -0.38 0.14 0.00 -1.20 0.00 0.00 0.00 178.15 176.72 2wn8 n SER 88 N -4.72 0.40 0.00 1.72 7.64 -0.93 -2.23 113.62 115.50 2wn8 n SER 88 Ca 0.09 0.63 0.13 0.00 1.01 0.00 0.00 58.87 60.72 2wn8 n SER 88 Cb 0.14 -0.70 0.56 0.00 -1.01 0.00 0.00 64.21 63.20 2wn8 n SER 88 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2wn8 n LYS 89 N -1.97 0.01 -3.36 1.43 4.76 -0.63 -4.34 118.16 114.05 2wn8 n LYS 89 Ca 0.01 0.05 -0.26 0.00 -2.87 0.00 0.00 58.31 55.24 2wn8 n LYS 89 Cb 0.13 -1.51 -0.08 0.00 -1.84 0.00 0.00 35.03 31.74 2wn8 n LYS 89 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2wn8 n ASN 90 N -1.52 1.66 -4.76 4.39 5.15 -0.95 -5.07 115.26 114.17 2wn8 n ASN 90 Ca 0.06 -2.98 -0.38 0.00 -0.60 0.00 0.00 54.58 50.69 2wn8 n ASN 90 Cb 0.31 -0.65 -0.06 0.00 -0.53 0.00 0.00 39.78 38.85 2wn8 n ASN 90 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2wn8 s LYS 91 N -1.55 4.21 0.18 1.20 1.02 -1.26 -1.05 119.74 122.49 2wn8 s LYS 91 Ca 0.36 0.44 -0.30 0.00 0.02 0.00 0.00 55.97 56.49 2wn8 s LYS 91 Cb 0.13 -3.36 -0.07 0.00 -0.52 0.00 0.00 37.83 34.00 2wn8 s LYS 91 CO -0.09 0.35 1.05 0.96 -0.92 0.00 0.00 175.35 176.70 2wn8 s ILE 92 N 0.01 4.00 -1.61 2.17 -4.36 -0.76 -4.89 121.20 115.76 2wn8 s ILE 92 Ca 0.25 1.76 0.30 0.00 -0.26 0.00 0.00 60.65 62.69 2wn8 s ILE 92 Cb -0.16 -4.12 0.63 0.00 1.25 0.00 0.00 42.46 40.06 2wn8 s ILE 92 CO 0.11 0.32 2.07 -0.67 0.24 0.00 0.00 174.94 177.01 2wn8 n ASP 93 N 2.28 0.00 -3.75 4.36 2.03 -1.26 -0.53 116.55 119.69 2wn8 n ASP 93 Ca 0.02 -0.39 -0.10 0.00 0.52 0.00 0.00 54.79 54.84 2wn8 n ASP 93 Cb 0.47 -0.20 -0.06 0.00 -0.72 0.00 0.00 41.12 40.61 2wn8 n ASP 93 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 2wn8 s LYS 94 N -2.39 0.98 0.41 -0.67 -2.85 -1.26 -4.74 119.74 109.21 2wn8 s LYS 94 Ca 0.34 -0.84 -0.26 0.00 -1.00 0.00 0.00 55.97 54.20 2wn8 s LYS 94 Cb 0.20 0.41 -0.10 0.00 -2.06 0.00 0.00 37.83 36.28 2wn8 s LYS 94 CO 0.42 -0.36 1.31 -2.30 0.10 0.00 0.00 175.35 174.52 2wn8 n PRO 95 N -0.15 2.06 -4.22 1.78 -0.02 -1.26 -4.54 135.00 128.65 2wn8 n PRO 95 Ca -0.15 0.73 -0.16 0.00 -2.02 0.00 0.00 63.50 61.89 2wn8 n PRO 95 Cb 0.63 -2.42 -0.14 0.00 -0.02 0.00 0.00 33.50 31.55 2wn8 n PRO 95 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2wn8 s MET 96 N -2.16 0.57 -0.13 -0.52 1.75 -0.79 -4.94 119.30 113.07 2wn8 s MET 96 Ca 0.59 -0.37 -0.13 0.00 -1.25 0.00 0.00 55.69 54.54 2wn8 s MET 96 Cb -0.51 -0.52 -0.05 0.00 2.84 0.00 0.00 34.83 36.59 2wn8 s MET 96 CO 0.59 0.14 0.28 0.71 -0.65 0.00 0.00 175.02 176.08 2wn8 s TYR 97 N -0.41 3.52 0.13 4.11 2.02 -1.26 0.60 117.35 126.06 2wn8 s TYR 97 Ca 0.00 0.63 0.07 0.00 -0.37 0.00 0.00 57.07 57.40 2wn8 s TYR 97 Cb -0.04 -2.26 -0.04 0.00 -0.40 0.00 0.00 41.96 39.22 2wn8 s TYR 97 CO -0.00 0.38 -0.17 0.14 -1.57 0.00 0.00 175.55 174.33 2wn8 s VAL 98 N -0.01 1.57 -0.10 0.71 -7.23 -0.22 -4.73 120.40 110.40 2wn8 s VAL 98 Ca 0.17 -1.70 0.01 0.00 -1.81 0.00 0.00 61.98 58.65 2wn8 s VAL 98 Cb -0.13 -1.60 -0.02 0.00 0.56 0.00 0.00 36.38 35.19 2wn8 s VAL 98 CO 0.05 -0.27 -0.12 -0.31 -0.31 0.00 0.00 175.10 174.14 2wn8 s TYR 99 N -1.76 2.81 -0.01 2.82 2.02 0.11 -0.83 117.35 122.51 2wn8 s TYR 99 Ca 0.09 -0.35 -0.29 0.00 -0.37 0.00 0.00 57.07 56.16 2wn8 s TYR 99 Cb -0.07 -1.76 0.07 0.00 -0.40 0.00 0.00 41.96 39.80 2wn8 s TYR 99 CO 0.04 0.02 0.65 1.52 -1.57 0.00 0.00 175.55 176.21 2wn8 s TYR 100 N -0.18 -0.61 0.23 2.71 -0.85 -0.89 -0.98 117.35 116.77 2wn8 s TYR 100 Ca 0.01 0.92 -0.16 0.00 -0.52 0.00 0.00 57.07 57.32 2wn8 s TYR 100 Cb -0.13 0.42 -0.08 0.00 0.38 0.00 0.00 41.96 42.55 2wn8 s TYR 100 CO 0.03 -0.65 0.66 -0.06 -1.52 0.00 0.00 175.55 174.02 2wn8 s PHE 101 N -1.72 3.53 0.03 -3.49 0.08 -1.26 0.18 117.98 115.33 2wn8 s PHE 101 Ca -0.09 1.20 -0.05 0.00 0.12 0.00 0.00 56.93 58.11 2wn8 s PHE 101 Cb -0.00 -2.49 -0.01 0.00 -0.57 0.00 0.00 43.02 39.95 2wn8 s PHE 101 CO 0.05 0.28 0.09 -2.00 -0.10 0.00 0.00 175.22 173.54 2wn8 s GLU 102 N -2.36 0.54 0.08 0.44 2.56 -0.72 -4.91 118.70 114.32 2wn8 s GLU 102 Ca 0.45 -0.68 -0.30 0.00 0.00 0.00 0.00 54.97 54.45 2wn8 s GLU 102 Cb -0.14 0.21 -0.05 0.00 2.00 0.00 0.00 34.13 36.15 2wn8 s GLU 102 CO 0.20 -0.13 0.97 0.45 -0.56 0.00 0.00 175.26 176.19 2wn8 s SER 103 N -1.92 7.45 0.48 -1.70 0.15 -1.26 -4.20 113.70 112.70 2wn8 s SER 103 Ca -0.08 1.76 0.21 0.00 0.70 0.00 0.00 55.95 58.54 2wn8 s SER 103 Cb -0.03 -2.58 1.24 0.00 -1.71 0.00 0.00 66.02 62.93 2wn8 s SER 103 CO -0.03 -0.14 1.96 1.55 1.20 0.00 0.00 173.24 177.79 2wn8 h PRO 104 N 5.96 0.19 -0.87 5.44 0.13 -1.90 -0.47 132.00 140.47 2wn8 h PRO 104 Ca -0.42 -0.01 0.24 0.00 -0.87 0.00 0.00 66.00 64.93 2wn8 h PRO 104 Cb 1.21 -0.04 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 2wn8 h PRO 104 CO 0.73 0.12 0.61 1.49 -0.23 0.00 0.00 178.00 180.72 2wn8 h GLU 105 N 0.19 0.09 -0.02 0.86 4.81 -1.81 0.25 114.58 118.95 2wn8 h GLU 105 Ca 0.30 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.53 2wn8 h GLU 105 Cb 0.93 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.28 2wn8 h GLU 105 CO -0.05 0.06 0.06 -0.22 -0.73 0.00 0.00 179.01 178.13 2wn8 h LYS 106 N 0.10 0.00 -0.18 1.92 1.63 -1.39 -1.68 116.57 116.96 2wn8 h LYS 106 Ca 0.42 0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 60.13 2wn8 h LYS 106 Cb 1.53 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 33.11 2wn8 h LYS 106 CO -0.05 0.00 -0.25 1.19 -3.45 0.00 0.00 179.45 176.89 2wn8 n PHE 107 N -3.34 0.58 -2.57 1.91 3.72 0.85 -4.96 117.46 113.64 2wn8 n PHE 107 Ca -0.02 -1.50 -0.18 0.00 -0.05 0.00 0.00 57.45 55.69 2wn8 n PHE 107 Cb 0.14 -0.37 0.01 0.00 -0.94 0.00 0.00 39.48 38.32 2wn8 n PHE 107 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wn8 n ALA 108 N -1.12 -0.65 -3.73 4.37 0.00 -0.63 -4.72 120.51 114.03 2wn8 n ALA 108 Ca 0.26 0.19 -0.36 0.00 0.00 0.00 0.00 53.44 53.53 2wn8 n ALA 108 Cb 0.87 -2.55 -0.10 0.00 0.00 0.00 0.00 19.45 17.67 2wn8 n ALA 108 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2wn8 s PHE 109 N -2.97 3.42 -0.38 0.00 5.36 -1.11 -4.99 117.98 117.30 2wn8 s PHE 109 Ca 0.11 -2.79 -0.03 0.00 -0.96 0.00 0.00 56.93 53.26 2wn8 s PHE 109 Cb -0.05 -3.16 0.13 0.00 -0.34 0.00 0.00 43.02 39.60 2wn8 s PHE 109 CO 0.13 -0.82 2.44 0.09 -1.46 0.00 0.00 175.22 175.61 2wn8 n ASN 110 N 3.31 6.47 -3.82 6.13 3.02 -1.26 -2.66 115.26 126.45 2wn8 n ASN 110 Ca 0.09 -3.14 -0.08 0.00 -0.03 0.00 0.00 54.58 51.43 2wn8 n ASN 110 Cb 0.37 -1.15 -0.02 0.00 -0.61 0.00 0.00 39.78 38.36 2wn8 n ASN 110 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2wn8 s LYS 111 N -1.73 1.70 0.43 3.52 -2.85 -1.26 -5.06 119.74 114.49 2wn8 s LYS 111 Ca 0.47 -0.95 -0.22 0.00 -1.00 0.00 0.00 55.97 54.27 2wn8 s LYS 111 Cb 0.32 0.59 -0.09 0.00 -2.06 0.00 0.00 37.83 36.59 2wn8 s LYS 111 CO -0.11 -0.77 1.02 0.14 0.10 0.00 0.00 175.35 175.73 2wn8 s VAL 112 N -3.91 3.87 0.07 1.79 -7.23 -1.26 -4.78 120.40 108.95 2wn8 s VAL 112 Ca 0.11 1.30 -0.16 0.00 -1.81 0.00 0.00 61.98 61.41 2wn8 s VAL 112 Cb -0.05 -3.60 -0.14 0.00 0.56 0.00 0.00 36.38 33.15 2wn8 s VAL 112 CO 0.05 -0.12 1.32 0.40 -0.31 0.00 0.00 175.10 176.44 2wn8 h ILE 113 N 1.95 1.33 -3.07 -0.62 2.04 -1.98 -3.47 117.51 113.69 2wn8 h ILE 113 Ca -0.49 -1.64 -0.02 0.00 1.00 0.00 0.00 64.86 63.72 2wn8 h ILE 113 Cb 1.21 1.90 -0.12 0.00 -0.74 0.00 0.00 36.82 39.07 2wn8 h ILE 113 CO 0.61 0.51 0.16 0.00 0.00 0.00 0.00 178.15 179.43 2wn8 s ARG 114 N -4.02 1.29 0.76 2.37 1.70 -1.26 -4.72 118.95 115.08 2wn8 s ARG 114 Ca -0.12 -0.56 -0.11 0.00 -0.47 0.00 0.00 55.73 54.47 2wn8 s ARG 114 Cb 0.07 0.57 0.05 0.00 -0.57 0.00 0.00 34.95 35.07 2wn8 s ARG 114 CO 0.83 -0.56 1.09 0.95 -1.08 0.00 0.00 175.30 176.53 2wn8 s THR 115 N -3.78 3.41 -0.68 4.99 -4.23 -1.26 -4.88 115.64 109.21 2wn8 s THR 115 Ca 0.02 0.47 0.25 0.00 -1.18 0.00 0.00 61.69 61.25 2wn8 s THR 115 Cb -0.01 -2.98 0.26 0.00 1.34 0.00 0.00 72.50 71.11 2wn8 s THR 115 CO -0.11 -0.59 1.75 -0.62 -0.54 0.00 0.00 174.62 174.51 2wn8 n GLU 116 N -3.44 0.20 -0.19 3.99 -0.58 -1.26 -2.38 120.64 116.98 2wn8 n GLU 116 Ca 0.09 0.27 0.07 0.00 -0.42 0.00 0.00 57.16 57.17 2wn8 n GLU 116 Cb 0.53 -1.78 0.19 0.00 -0.57 0.00 0.00 31.44 29.80 2wn8 n GLU 116 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2wn8 n ASN 117 N -2.14 2.08 -4.58 1.62 0.23 -1.26 -4.92 115.26 106.29 2wn8 n ASN 117 Ca 0.04 -1.98 -0.30 0.00 -0.53 0.00 0.00 54.58 51.81 2wn8 n ASN 117 Cb 0.33 -0.25 -0.10 0.00 -2.08 0.00 0.00 39.78 37.68 2wn8 n ASN 117 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 2wn8 s GLN 118 N -1.50 2.26 -0.13 -3.83 -0.21 -1.00 -5.04 119.66 110.21 2wn8 s GLN 118 Ca 0.27 -0.93 -0.04 0.00 0.02 0.00 0.00 55.36 54.67 2wn8 s GLN 118 Cb 0.14 -2.36 -0.25 0.00 1.00 0.00 0.00 33.01 31.54 2wn8 s GLN 118 CO 0.18 0.54 0.33 0.09 -2.12 0.00 0.00 175.29 174.31 2wn8 n ASN 119 N 0.98 2.00 -4.87 5.90 3.02 -1.26 -4.83 115.26 116.19 2wn8 n ASN 119 Ca -0.14 0.19 -0.32 0.00 -0.03 0.00 0.00 54.58 54.28 2wn8 n ASN 119 Cb 0.52 -0.75 -0.05 0.00 -0.61 0.00 0.00 39.78 38.89 2wn8 n ASN 119 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2wn8 s GLU 120 N -2.56 3.79 -0.18 3.52 8.01 -1.26 -0.53 118.70 129.49 2wn8 s GLU 120 Ca -0.22 0.22 0.01 0.00 0.01 0.00 0.00 54.97 54.99 2wn8 s GLU 120 Cb 0.07 -2.75 0.02 0.00 -4.31 0.00 0.00 34.13 27.16 2wn8 s GLU 120 CO 0.76 0.38 -0.19 0.42 0.01 0.00 0.00 175.26 176.65 2wn8 s ILE 121 N -1.71 2.19 0.51 -1.63 1.01 -1.26 -4.83 121.20 115.48 2wn8 s ILE 121 Ca 0.44 -0.90 -0.22 0.00 0.00 0.00 0.00 60.65 59.97 2wn8 s ILE 121 Cb -0.12 -1.92 -0.06 0.00 0.01 0.00 0.00 42.46 40.37 2wn8 s ILE 121 CO 0.21 0.53 1.21 -0.94 0.00 0.00 0.00 174.94 175.96 2wn8 s SER 122 N 1.23 5.75 0.58 3.58 1.04 -1.26 -4.91 113.70 119.70 2wn8 s SER 122 Ca 0.03 2.41 0.36 0.00 0.48 0.00 0.00 55.95 59.24 2wn8 s SER 122 Cb -0.13 -2.61 1.62 0.00 0.10 0.00 0.00 66.02 65.00 2wn8 s SER 122 CO -0.10 -1.22 2.08 -0.07 0.98 0.00 0.00 173.24 174.91 2wn8 h LEU 123 N 1.62 0.00 -0.36 2.42 3.38 -2.00 -1.94 115.31 118.43 2wn8 h LEU 123 Ca -0.50 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.38 2wn8 h LEU 123 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 2wn8 h LEU 123 CO 0.58 0.00 -0.11 -0.33 0.09 0.00 0.00 178.44 178.68 2wn8 h GLU 124 N 0.00 0.71 -0.72 1.13 5.08 -1.99 -2.24 114.58 116.54 2wn8 h GLU 124 Ca -0.00 -0.28 -0.03 0.00 -1.00 0.00 0.00 59.36 58.05 2wn8 h GLU 124 Cb 0.39 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.58 2wn8 h GLU 124 CO 0.00 0.88 0.33 0.87 -1.00 0.00 0.00 179.01 180.09 2wn8 h LYS 125 N 0.51 1.05 -0.04 2.33 1.79 -1.75 0.28 116.57 120.74 2wn8 h LYS 125 Ca 0.09 -0.16 0.03 0.00 -2.18 0.00 0.00 60.65 58.43 2wn8 h LYS 125 Cb 0.63 -0.18 -0.04 0.00 -1.58 0.00 0.00 32.23 31.05 2wn8 h LYS 125 CO 0.04 0.83 -0.17 0.35 -1.08 0.00 0.00 179.45 179.42 2wn8 h PHE 126 N 1.02 -0.44 -0.34 -1.35 3.57 -1.38 0.26 116.94 118.28 2wn8 h PHE 126 Ca 0.25 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.70 2wn8 h PHE 126 Cb 0.14 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.07 2wn8 h PHE 126 CO 0.01 -0.25 -0.06 -0.91 -2.23 0.00 0.00 178.31 174.87 2wn8 h ASN 127 N -0.26 0.53 -0.38 0.41 -0.26 -1.16 -1.10 115.58 113.36 2wn8 h ASN 127 Ca 0.07 -0.12 -0.05 0.00 -0.56 0.00 0.00 56.30 55.64 2wn8 h ASN 127 Cb 0.35 -0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 37.45 2wn8 h ASN 127 CO -0.19 0.65 0.06 -0.08 -1.06 0.00 0.00 177.43 176.81 2wn8 h GLU 128 N 0.52 0.63 -0.45 0.81 4.81 -0.56 -0.18 114.58 120.17 2wn8 h GLU 128 Ca 0.10 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 2wn8 h GLU 128 Cb 0.43 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 2wn8 h GLU 128 CO 0.02 0.69 0.14 0.35 -0.73 0.00 0.00 179.01 179.48 2wn8 h PHE 129 N 0.48 0.72 -0.21 0.92 3.57 -0.72 -1.59 116.94 120.10 2wn8 h PHE 129 Ca 0.12 -0.07 0.05 0.00 3.53 0.00 0.00 57.97 61.60 2wn8 h PHE 129 Cb 0.36 -0.21 -0.06 0.00 2.79 0.00 0.00 35.95 38.84 2wn8 h PHE 129 CO 0.02 0.65 -0.14 -0.22 -2.23 0.00 0.00 178.31 176.39 2wn8 h LYS 130 N 0.59 -0.13 -0.84 1.11 1.63 -1.12 -1.96 116.57 115.85 2wn8 h LYS 130 Ca 0.14 0.01 0.09 0.00 -0.85 0.00 0.00 60.65 60.04 2wn8 h LYS 130 Cb 0.27 0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 31.87 2wn8 h LYS 130 CO -0.00 -0.09 0.54 1.49 -3.45 0.00 0.00 179.45 177.94 2wn8 h GLU 131 N -0.13 0.80 -0.07 1.90 4.57 -0.80 -1.23 114.58 119.62 2wn8 h GLU 131 Ca 0.12 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 2wn8 h GLU 131 Cb 0.32 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 28.73 2wn8 h GLU 131 CO -0.30 0.53 -0.02 1.15 -1.18 0.00 0.00 179.01 179.20 2wn8 h THR 132 N 0.82 1.29 0.00 0.32 2.02 -0.74 -3.29 112.91 113.33 2wn8 h THR 132 Ca 0.38 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 66.65 2wn8 h THR 132 Cb 0.39 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.56 2wn8 h THR 132 CO -0.15 0.25 -0.50 2.30 0.37 0.00 0.00 175.52 177.79 2wn8 n ILE 133 N -4.82 0.26 -1.70 3.11 -6.64 -0.79 -4.90 119.36 103.89 2wn8 n ILE 133 Ca -0.07 -0.19 -0.56 0.00 -1.77 0.00 0.00 62.75 60.16 2wn8 n ILE 133 Cb 0.22 -0.10 -0.07 0.00 -1.44 0.00 0.00 39.64 38.25 2wn8 n ILE 133 CO 0.00 0.00 0.00 1.67 -1.77 0.00 0.00 176.55 176.45 2wn8 n GLN 134 N -1.93 1.30 -3.05 6.28 7.27 -0.48 -2.78 117.38 123.99 2wn8 n GLN 134 Ca 0.04 0.47 -0.22 0.00 0.07 0.00 0.00 57.00 57.36 2wn8 n GLN 134 Cb 0.41 -2.20 0.03 0.00 2.41 0.00 0.00 30.24 30.89 2wn8 n GLN 134 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2wn8 n ASN 135 N 5.80 -5.84 -4.31 1.69 3.02 -1.26 -4.99 115.26 109.37 2wn8 n ASN 135 Ca 0.27 -0.29 -0.23 0.00 -0.03 0.00 0.00 54.58 54.30 2wn8 n ASN 135 Cb 0.16 -4.73 -0.12 0.00 -0.61 0.00 0.00 39.78 34.48 2wn8 n ASN 135 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2wn8 s LYS 136 N -5.73 1.19 -0.07 3.52 1.02 -1.12 -5.15 119.74 113.40 2wn8 s LYS 136 Ca 0.31 -1.28 -0.04 0.00 0.02 0.00 0.00 55.97 54.98 2wn8 s LYS 136 Cb -0.14 -1.34 -0.04 0.00 -0.52 0.00 0.00 37.83 35.79 2wn8 s LYS 136 CO 0.38 0.29 0.11 -0.51 -0.92 0.00 0.00 175.35 174.70 2wn8 s LEU 137 N -2.29 4.13 -0.10 3.17 1.43 -1.26 -4.54 118.68 119.22 2wn8 s LEU 137 Ca 0.11 0.32 -0.00 0.00 -1.03 0.00 0.00 54.13 53.52 2wn8 s LEU 137 Cb -0.08 -2.15 0.02 0.00 0.03 0.00 0.00 46.19 44.01 2wn8 s LEU 137 CO 0.05 0.35 -0.06 -0.36 0.23 0.00 0.00 176.35 176.56 2wn8 s PHE 138 N -1.09 1.29 0.17 0.29 0.08 0.15 -4.84 117.98 114.04 2wn8 s PHE 138 Ca 0.18 -0.58 -0.31 0.00 0.12 0.00 0.00 56.93 56.34 2wn8 s PHE 138 Cb -0.12 -1.11 -0.08 0.00 -0.57 0.00 0.00 43.02 41.14 2wn8 s PHE 138 CO 0.08 -0.44 1.35 0.15 -0.10 0.00 0.00 175.22 176.27 2wn8 s LYS 139 N 1.60 4.35 -0.08 0.44 -0.14 -1.26 0.01 119.74 124.66 2wn8 s LYS 139 Ca 0.02 2.08 0.04 0.00 -1.36 0.00 0.00 55.97 56.75 2wn8 s LYS 139 Cb -0.13 -3.21 0.00 0.00 -1.68 0.00 0.00 37.83 32.81 2wn8 s LYS 139 CO -0.06 -0.34 -0.20 -0.65 -0.76 0.00 0.00 175.35 173.34 2wn8 s GLN 140 N 0.38 2.47 0.05 1.68 -1.52 0.08 -4.93 119.66 117.87 2wn8 s GLN 140 Ca 0.60 -0.71 -0.00 0.00 -1.95 0.00 0.00 55.36 53.30 2wn8 s GLN 140 Cb -0.37 -1.94 -0.03 0.00 -0.22 0.00 0.00 33.01 30.45 2wn8 s GLN 140 CO 0.35 0.15 -0.04 -0.51 -0.25 0.00 0.00 175.29 174.99 2wn8 s ASP 141 N 0.38 0.52 0.00 5.90 1.01 -1.26 -2.05 116.67 121.18 2wn8 s ASP 141 Ca -0.15 -0.81 0.00 0.00 0.71 0.00 0.00 52.55 52.30 2wn8 s ASP 141 Cb -0.16 0.14 0.00 0.00 1.01 0.00 0.00 42.92 43.91 2wn8 s ASP 141 CO 0.06 -0.46 0.00 0.61 0.21 0.00 0.00 175.17 175.60 2wn8 n GLY 142 N 0.67 -0.05 3.77 0.21 0.00 -0.73 -4.71 105.19 104.35 2wn8 n GLY 142 Ca -0.18 -1.82 -0.37 0.00 0.00 0.00 0.00 46.02 43.65 2wn8 n GLY 142 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wn8 s PHE 143 N -1.75 2.89 -0.16 1.61 0.08 -1.26 -1.31 117.98 118.08 2wn8 s PHE 143 Ca 0.00 1.54 -0.11 0.00 0.12 0.00 0.00 56.93 58.47 2wn8 s PHE 143 Cb 0.00 -3.37 0.05 0.00 -0.57 0.00 0.00 43.02 39.13 2wn8 s PHE 143 CO 0.00 -1.48 0.41 0.21 -0.10 0.00 0.00 175.22 174.26 2wn8 s LYS 144 N -2.67 0.43 -0.11 0.44 2.20 -0.52 -4.88 119.74 114.62 2wn8 s LYS 144 Ca 0.63 0.68 -0.26 0.00 -0.36 0.00 0.00 55.97 56.67 2wn8 s LYS 144 Cb -0.29 0.09 -0.02 0.00 -1.51 0.00 0.00 37.83 36.10 2wn8 s LYS 144 CO 0.35 -0.11 0.82 -0.51 -0.36 0.00 0.00 175.35 175.53 2wn8 s ASP 145 N 0.86 7.04 0.46 1.43 1.01 -1.26 -1.47 116.67 124.74 2wn8 s ASP 145 Ca -0.05 1.27 0.04 0.00 0.71 0.00 0.00 52.55 54.51 2wn8 s ASP 145 Cb -0.06 -2.46 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 2wn8 s ASP 145 CO -0.07 -0.29 0.01 0.27 0.21 0.00 0.00 175.17 175.31 2wn8 s ILE 146 N 1.53 1.44 0.00 0.77 -5.25 0.85 -4.81 121.20 115.73 2wn8 s ILE 146 Ca 0.40 -2.00 0.04 0.00 -0.99 0.00 0.00 60.65 58.10 2wn8 s ILE 146 Cb -0.18 -2.50 -0.01 0.00 2.95 0.00 0.00 42.46 42.72 2wn8 s ILE 146 CO 0.17 0.00 -0.11 -0.55 -1.79 0.00 0.00 174.94 172.66 2wn8 s SER 147 N -3.79 1.31 0.00 4.36 0.15 -0.16 -3.11 113.70 112.47 2wn8 s SER 147 Ca 0.19 -0.26 0.29 0.00 0.70 0.00 0.00 55.95 56.86 2wn8 s SER 147 Cb 0.05 -0.12 1.17 0.00 -1.71 0.00 0.00 66.02 65.40 2wn8 s SER 147 CO 0.10 0.10 1.87 0.18 1.20 0.00 0.00 173.24 176.68 2wn8 n LEU 148 N 2.57 0.08 -4.46 3.45 4.77 -1.26 0.06 117.00 122.20 2wn8 n LEU 148 Ca -0.15 0.40 -0.27 0.00 -0.03 0.00 0.00 56.01 55.96 2wn8 n LEU 148 Cb 0.56 -0.44 -0.11 0.00 -2.33 0.00 0.00 43.42 41.10 2wn8 n LEU 148 CO 0.24 0.02 -0.50 -0.31 -1.33 0.00 0.00 177.39 175.51 2wn8 s TYR 149 N -2.95 2.39 0.24 -1.77 2.02 -1.26 -4.87 117.35 111.15 2wn8 s TYR 149 Ca 0.15 -0.32 -0.30 0.00 -0.37 0.00 0.00 57.07 56.23 2wn8 s TYR 149 Cb 0.19 -1.18 -0.11 0.00 -0.40 0.00 0.00 41.96 40.46 2wn8 s TYR 149 CO 0.54 0.50 1.53 -2.00 -1.57 0.00 0.00 175.55 174.56 2wn8 s GLU 150 N -2.70 4.20 0.42 -0.62 2.12 -1.26 -4.76 118.70 116.10 2wn8 s GLU 150 Ca 0.22 2.42 -0.25 0.00 0.36 0.00 0.00 54.97 57.71 2wn8 s GLU 150 Cb -0.08 -3.09 -0.08 0.00 0.26 0.00 0.00 34.13 31.14 2wn8 s GLU 150 CO 0.11 -0.54 1.22 -1.25 -0.54 0.00 0.00 175.26 174.26 2wn8 s PRO 151 N 0.00 3.94 0.00 4.30 0.04 -1.26 -5.05 135.00 136.98 2wn8 s PRO 151 Ca 0.64 1.96 0.00 0.00 0.04 0.00 0.00 61.00 63.63 2wn8 s PRO 151 Cb -0.45 -2.65 0.00 0.00 0.04 0.00 0.00 34.50 31.44 2wn8 s PRO 151 CO 0.41 -0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.42 2wn8 n GLY 152 N 0.63 6.17 0.27 0.56 0.00 -1.26 -5.01 105.19 106.55 2wn8 n GLY 152 Ca 0.05 -2.04 0.01 0.00 0.00 0.00 0.00 46.02 44.04 2wn8 n GLY 152 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wn8 h LYS 153 N 0.00 0.01 -0.05 1.61 1.79 -1.96 -2.94 116.57 115.02 2wn8 h LYS 153 Ca 0.00 -0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.24 2wn8 h LYS 153 Cb 0.00 -0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.66 2wn8 h LYS 153 CO 0.00 0.01 -0.89 0.78 -1.08 0.00 0.00 179.45 178.27 2wn8 h GLY 154 N 0.01 0.64 -2.01 3.86 0.00 -2.03 -3.47 103.07 100.08 2wn8 h GLY 154 Ca 0.34 -1.02 -0.55 0.00 0.00 0.00 0.00 47.33 46.11 2wn8 h GLY 154 CO -0.72 0.90 0.48 0.99 0.00 0.00 0.00 176.54 178.19 2wn8 s ASP 155 N -7.12 4.50 -0.04 0.19 1.01 -1.11 -4.95 116.67 109.16 2wn8 s ASP 155 Ca -0.08 2.54 -0.30 0.00 0.71 0.00 0.00 52.55 55.42 2wn8 s ASP 155 Cb 0.09 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 2wn8 s ASP 155 CO 0.88 -2.07 1.24 -1.83 0.21 0.00 0.00 175.17 173.60 2wn8 s GLU 156 N -3.52 4.35 -0.63 8.23 -1.05 -1.26 -4.86 118.70 119.95 2wn8 s GLU 156 Ca 0.80 1.73 0.05 0.00 -0.15 0.00 0.00 54.97 57.40 2wn8 s GLU 156 Cb -0.35 -3.54 0.17 0.00 -0.44 0.00 0.00 34.13 29.97 2wn8 s GLU 156 CO 0.41 -0.46 0.46 1.63 0.95 0.00 0.00 175.26 178.25 2wn8 n LYS 157 N 5.14 1.42 0.13 -4.83 5.02 -1.26 -4.99 118.16 118.79 2wn8 n LYS 157 Ca 0.11 -4.15 0.13 0.00 -2.02 0.00 0.00 58.31 52.38 2wn8 n LYS 157 Cb 0.46 -2.12 0.44 0.00 -0.02 0.00 0.00 35.03 33.78 2wn8 n LYS 157 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2wn8 h PRO 158 N 5.41 0.00 -4.67 1.97 0.13 -1.97 -3.46 132.00 129.41 2wn8 h PRO 158 Ca 0.18 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 65.05 2wn8 h PRO 158 Cb 0.79 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 31.77 2wn8 h PRO 158 CO 0.63 0.00 -0.64 0.95 -0.23 0.00 0.00 178.00 178.71 2wn8 s THR 159 N -3.22 0.36 -2.10 1.56 -4.23 -1.26 -5.04 115.64 101.70 2wn8 s THR 159 Ca 0.07 -1.97 0.19 0.00 -1.18 0.00 0.00 61.69 58.81 2wn8 s THR 159 Cb 0.10 -2.28 0.49 0.00 1.34 0.00 0.00 72.50 72.15 2wn8 s THR 159 CO 0.53 -0.28 1.64 -2.65 -0.54 0.00 0.00 174.62 173.31 2wn8 n PRO 160 N -0.25 1.27 -3.97 3.99 -0.02 -1.26 -4.76 135.00 130.00 2wn8 n PRO 160 Ca -0.03 -0.40 -0.34 0.00 -2.02 0.00 0.00 63.50 60.71 2wn8 n PRO 160 Cb 0.65 -1.32 -0.14 0.00 -0.02 0.00 0.00 33.50 32.66 2wn8 n PRO 160 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2wn8 s LEU 161 N -1.56 3.34 -0.26 2.45 2.96 -1.26 -0.35 118.68 124.00 2wn8 s LEU 161 Ca 0.29 -1.01 -0.08 0.00 -0.22 0.00 0.00 54.13 53.10 2wn8 s LEU 161 Cb 0.14 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 45.15 2wn8 s LEU 161 CO 0.23 -0.16 0.10 -0.22 -1.32 0.00 0.00 176.35 174.98 2wn8 s LEU 162 N 1.28 3.65 0.04 -0.68 2.96 0.86 -1.75 118.68 125.04 2wn8 s LEU 162 Ca -0.02 -0.23 -0.25 0.00 -0.22 0.00 0.00 54.13 53.41 2wn8 s LEU 162 Cb -0.18 -1.97 -0.05 0.00 0.50 0.00 0.00 46.19 44.49 2wn8 s LEU 162 CO -0.04 -0.06 0.77 -0.04 -1.32 0.00 0.00 176.35 175.65 2wn8 s MET 163 N 1.64 4.49 -0.39 1.98 -1.94 0.13 -1.01 119.30 124.20 2wn8 s MET 163 Ca 0.06 1.06 0.03 0.00 -1.71 0.00 0.00 55.69 55.13 2wn8 s MET 163 Cb -0.16 -3.37 0.11 0.00 2.01 0.00 0.00 34.83 33.43 2wn8 s MET 163 CO 0.05 0.27 0.13 -1.58 -0.01 0.00 0.00 175.02 173.88 2wn8 s HIS 164 N 0.00 3.20 -0.16 -0.03 2.46 -0.54 -2.10 115.29 118.12 2wn8 s HIS 164 Ca 0.39 -2.84 -0.04 0.00 0.47 0.00 0.00 55.06 53.03 2wn8 s HIS 164 Cb -0.20 -2.66 -0.03 0.00 -0.13 0.00 0.00 32.58 29.56 2wn8 s HIS 164 CO 0.23 -0.87 -0.02 -1.17 -2.47 0.00 0.00 174.74 170.43 2wn8 s LEU 165 N 0.64 3.32 -0.42 8.88 2.96 -0.01 -1.66 118.68 132.39 2wn8 s LEU 165 Ca 0.13 -0.11 -0.27 0.00 -0.22 0.00 0.00 54.13 53.66 2wn8 s LEU 165 Cb -0.21 -1.81 0.02 0.00 0.50 0.00 0.00 46.19 44.70 2wn8 s LEU 165 CO -0.07 0.16 1.02 -0.75 -1.32 0.00 0.00 176.35 175.39 2wn8 s LYS 166 N 0.41 3.76 0.04 1.98 2.20 -0.51 -1.05 119.74 126.56 2wn8 s LYS 166 Ca -0.03 0.55 -0.25 0.00 -0.36 0.00 0.00 55.97 55.88 2wn8 s LYS 166 Cb -0.14 -3.86 -0.05 0.00 -1.51 0.00 0.00 37.83 32.27 2wn8 s LYS 166 CO 0.03 -1.16 0.75 -0.51 -0.36 0.00 0.00 175.35 174.10 2wn8 s LEU 167 N 3.90 4.44 0.77 5.43 1.43 0.20 -3.76 118.68 131.10 2wn8 s LEU 167 Ca 0.42 1.42 -0.12 0.00 -1.03 0.00 0.00 54.13 54.83 2wn8 s LEU 167 Cb -0.10 -3.21 0.06 0.00 0.03 0.00 0.00 46.19 42.97 2wn8 s LEU 167 CO 0.24 0.01 1.11 -2.16 0.23 0.00 0.00 176.35 175.79 2wn8 s PRO 168 N -0.02 2.16 0.47 1.29 0.04 -1.26 -1.89 135.00 135.79 2wn8 s PRO 168 Ca 0.38 1.32 -0.22 0.00 0.04 0.00 0.00 61.00 62.52 2wn8 s PRO 168 Cb -0.20 -1.88 -0.10 0.00 0.04 0.00 0.00 34.50 32.36 2wn8 s PRO 168 CO 0.22 -1.74 0.72 -2.13 0.04 0.00 0.00 177.00 174.12 2wn8 n ARG 169 N -3.35 0.81 -2.04 4.56 0.63 -1.26 -3.13 116.66 112.88 2wn8 n ARG 169 Ca 0.10 0.30 -0.09 0.00 -0.92 0.00 0.00 57.85 57.24 2wn8 n ARG 169 Cb 0.52 -1.77 -0.01 0.00 0.45 0.00 0.00 32.46 31.66 2wn8 n ARG 169 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 2wn8 n ASN 170 N 0.69 -3.24 -4.78 6.15 5.15 0.31 -4.97 115.26 114.57 2wn8 n ASN 170 Ca 0.11 0.02 -0.37 0.00 -0.60 0.00 0.00 54.58 53.74 2wn8 n ASN 170 Cb 0.42 -2.39 -0.06 0.00 -0.53 0.00 0.00 39.78 37.21 2wn8 n ASN 170 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2wn8 s THR 171 N -2.43 5.20 0.39 -0.44 2.01 -1.18 -4.76 115.64 114.43 2wn8 s THR 171 Ca 0.00 0.72 -0.25 0.00 0.31 0.00 0.00 61.69 62.46 2wn8 s THR 171 Cb 0.00 -3.68 -0.09 0.00 0.01 0.00 0.00 72.50 68.74 2wn8 s THR 171 CO 0.00 0.46 1.13 -0.83 -0.69 0.00 0.00 174.62 174.68 2wn8 s GLY 172 N -0.15 2.84 -0.15 4.40 0.00 -1.26 -1.82 107.32 111.18 2wn8 s GLY 172 Ca 0.21 0.88 -0.07 0.00 0.00 0.00 0.00 44.72 45.74 2wn8 s GLY 172 CO 0.09 1.37 0.34 -0.29 0.00 0.00 0.00 173.10 174.60 2wn8 s MET 173 N -2.30 0.27 -0.49 2.90 0.00 -0.22 -4.64 119.30 114.82 2wn8 s MET 173 Ca 0.56 0.78 0.01 0.00 0.00 0.00 0.00 55.69 57.04 2wn8 s MET 173 Cb -0.28 0.03 0.13 0.00 0.00 0.00 0.00 34.83 34.71 2wn8 s MET 173 CO 0.35 -0.21 0.25 -1.17 0.00 0.00 0.00 175.02 174.24 2wn8 s LEU 174 N 1.91 4.80 0.29 4.11 2.96 0.46 -4.62 118.68 128.58 2wn8 s LEU 174 Ca -0.05 -2.64 -0.29 0.00 -0.22 0.00 0.00 54.13 50.93 2wn8 s LEU 174 Cb -0.11 -1.72 -0.10 0.00 0.50 0.00 0.00 46.19 44.76 2wn8 s LEU 174 CO -0.11 -0.35 1.41 -2.84 -1.32 0.00 0.00 176.35 173.14 2wn8 s PRO 175 N 0.24 4.28 0.14 0.98 0.02 -1.26 -0.06 135.00 139.33 2wn8 s PRO 175 Ca 0.14 2.31 -0.09 0.00 0.02 0.00 0.00 61.00 63.38 2wn8 s PRO 175 Cb -0.22 -3.08 -0.01 0.00 0.02 0.00 0.00 34.50 31.21 2wn8 s PRO 175 CO -0.03 -0.37 0.25 1.52 -0.33 0.00 0.00 177.00 178.04 2wn8 s TYR 176 N -0.44 0.32 -0.15 6.54 -0.85 0.06 -4.73 117.35 118.10 2wn8 s TYR 176 Ca 0.56 -0.70 -0.04 0.00 -0.52 0.00 0.00 57.07 56.36 2wn8 s TYR 176 Cb -0.42 -0.06 -0.03 0.00 0.38 0.00 0.00 41.96 41.83 2wn8 s TYR 176 CO 0.48 -0.66 0.00 0.95 -1.52 0.00 0.00 175.55 174.81 2wn8 s THR 177 N -3.93 4.29 -0.12 -3.49 -4.23 -1.26 -1.05 115.64 105.84 2wn8 s THR 177 Ca 0.13 -0.23 -0.01 0.00 -1.18 0.00 0.00 61.69 60.41 2wn8 s THR 177 Cb 0.04 -2.88 -0.02 0.00 1.34 0.00 0.00 72.50 70.98 2wn8 s THR 177 CO -0.04 0.51 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.76 2wn8 s VAL 182 N 0.05 3.34 0.42 2.29 1.01 -1.26 -4.98 120.40 121.27 2wn8 s VAL 182 Ca 0.02 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.47 2wn8 s VAL 182 Cb -0.13 -2.41 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 2wn8 s VAL 182 CO 0.02 0.53 0.13 -0.55 0.00 0.00 0.00 175.10 175.23 2wn8 s SER 183 N 0.15 2.94 -0.06 3.32 0.15 -0.21 -5.11 113.70 114.87 2wn8 s SER 183 Ca -0.05 -1.71 0.00 0.00 0.70 0.00 0.00 55.95 54.89 2wn8 s SER 183 Cb -0.15 0.56 0.02 0.00 -1.71 0.00 0.00 66.02 64.75 2wn8 s SER 183 CO 0.04 -0.96 -0.04 -0.89 1.20 0.00 0.00 173.24 172.59 2wn8 s THR 184 N -3.17 0.56 -0.13 6.45 2.01 -1.18 -0.76 115.64 119.42 2wn8 s THR 184 Ca 0.22 -0.07 -0.15 0.00 0.31 0.00 0.00 61.69 61.99 2wn8 s THR 184 Cb 0.02 -0.62 -0.05 0.00 0.01 0.00 0.00 72.50 71.86 2wn8 s THR 184 CO 0.14 0.26 0.36 -0.22 -0.69 0.00 0.00 174.62 174.46 2wn8 s LEU 185 N 1.33 4.27 0.23 4.42 2.96 0.91 -0.10 118.68 132.71 2wn8 s LEU 185 Ca -0.04 0.63 0.07 0.00 -0.22 0.00 0.00 54.13 54.57 2wn8 s LEU 185 Cb -0.14 -2.48 -0.05 0.00 0.50 0.00 0.00 46.19 44.02 2wn8 s LEU 185 CO -0.02 0.09 -0.10 0.27 -1.32 0.00 0.00 176.35 175.27 2wn8 s ILE 186 N 0.37 1.64 -0.24 6.68 -4.36 -0.54 -0.41 121.20 124.34 2wn8 s ILE 186 Ca 0.20 -2.16 -0.01 0.00 -0.26 0.00 0.00 60.65 58.41 2wn8 s ILE 186 Cb -0.14 -2.22 0.02 0.00 1.25 0.00 0.00 42.46 41.37 2wn8 s ILE 186 CO 0.07 -0.46 -0.08 -0.70 0.24 0.00 0.00 174.94 174.00 2wn8 s GLU 187 N -3.70 2.87 0.38 0.37 2.12 -1.26 -1.44 118.70 118.04 2wn8 s GLU 187 Ca 0.26 -0.95 -0.23 0.00 0.36 0.00 0.00 54.97 54.40 2wn8 s GLU 187 Cb 0.02 -2.93 -0.10 0.00 0.26 0.00 0.00 34.13 31.37 2wn8 s GLU 187 CO 0.09 -0.37 0.95 -0.65 -0.54 0.00 0.00 175.26 174.74 2wn8 s GLN 188 N 1.32 4.38 -0.34 4.30 -0.21 -0.43 -4.90 119.66 123.78 2wn8 s GLN 188 Ca 0.01 1.21 0.03 0.00 0.02 0.00 0.00 55.36 56.63 2wn8 s GLN 188 Cb -0.16 -2.45 0.19 0.00 1.00 0.00 0.00 33.01 31.59 2wn8 s GLN 188 CO -0.05 0.10 1.20 0.41 -2.12 0.00 0.00 175.29 174.82 2wn8 n GLY 189 N -0.12 -0.66 3.39 3.09 0.00 -0.89 -1.77 105.19 108.23 2wn8 n GLY 189 Ca 0.05 0.23 -0.11 0.00 0.00 0.00 0.00 46.02 46.20 2wn8 n GLY 189 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2wn8 s TYR 190 N 0.07 -0.28 0.23 1.61 -0.85 -0.87 -4.98 117.35 112.28 2wn8 s TYR 190 Ca 0.11 -0.02 -0.30 0.00 -0.52 0.00 0.00 57.07 56.35 2wn8 s TYR 190 Cb 0.18 0.37 -0.09 0.00 0.38 0.00 0.00 41.96 42.80 2wn8 s TYR 190 CO -0.08 -0.79 0.99 -1.12 -1.52 0.00 0.00 175.55 173.04 2wn8 s SER 191 N -2.80 7.51 0.16 -0.18 0.01 -1.25 -0.74 113.70 116.40 2wn8 s SER 191 Ca 0.04 2.03 0.10 0.00 1.31 0.00 0.00 55.95 59.43 2wn8 s SER 191 Cb 0.00 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.58 2wn8 s SER 191 CO -0.10 0.03 -0.23 0.27 0.41 0.00 0.00 173.24 173.62 2wn8 s ILE 192 N -1.00 2.15 0.00 1.44 -4.36 0.10 -1.73 121.20 117.81 2wn8 s ILE 192 Ca 0.43 -1.89 0.07 0.00 -0.26 0.00 0.00 60.65 59.00 2wn8 s ILE 192 Cb -0.28 -1.97 -0.02 0.00 1.25 0.00 0.00 42.46 41.44 2wn8 s ILE 192 CO 0.34 -0.10 -0.20 -1.59 0.24 0.00 0.00 174.94 173.63 2wn8 s LYS 193 N -2.46 1.56 -0.44 0.37 -2.85 -0.33 -0.67 119.74 114.92 2wn8 s LYS 193 Ca 0.16 -0.79 -0.17 0.00 -1.00 0.00 0.00 55.97 54.18 2wn8 s LYS 193 Cb -0.08 -1.56 0.04 0.00 -2.06 0.00 0.00 37.83 34.16 2wn8 s LYS 193 CO 0.08 0.42 0.43 0.42 0.10 0.00 0.00 175.35 176.79 2wn8 s ILE 194 N -0.57 5.12 0.07 3.79 1.01 -1.26 -1.16 121.20 128.19 2wn8 s ILE 194 Ca 0.08 -0.56 -0.11 0.00 0.00 0.00 0.00 60.65 60.06 2wn8 s ILE 194 Cb -0.08 -4.07 -0.29 0.00 0.01 0.00 0.00 42.46 38.03 2wn8 s ILE 194 CO -0.00 -0.48 1.12 0.44 0.00 0.00 0.00 174.94 176.02 2wn8 h ASP 195 N 8.75 0.70 -4.60 3.58 3.32 -0.94 -3.45 116.42 123.79 2wn8 h ASP 195 Ca -0.27 -0.68 -0.11 0.00 0.02 0.00 0.00 57.03 55.98 2wn8 h ASP 195 Cb 1.11 -0.22 -0.21 0.00 0.22 0.00 0.00 39.33 40.22 2wn8 h ASP 195 CO 0.82 1.51 -0.21 -0.75 -1.72 0.00 0.00 179.24 178.89 2wn8 s LYS 196 N -2.85 0.65 0.09 3.56 2.20 -1.16 -5.02 119.74 117.20 2wn8 s LYS 196 Ca -0.07 0.13 0.10 0.00 -0.36 0.00 0.00 55.97 55.77 2wn8 s LYS 196 Cb 0.06 0.30 -0.03 0.00 -1.51 0.00 0.00 37.83 36.64 2wn8 s LYS 196 CO 0.91 -0.16 -0.27 0.96 -0.36 0.00 0.00 175.35 176.44 2wn8 s ILE 197 N -0.76 2.18 0.02 5.43 -4.36 -1.26 0.11 121.20 122.55 2wn8 s ILE 197 Ca -0.08 -1.56 0.01 0.00 -0.26 0.00 0.00 60.65 58.75 2wn8 s ILE 197 Cb -0.04 -1.90 -0.01 0.00 1.25 0.00 0.00 42.46 41.76 2wn8 s ILE 197 CO 0.04 0.23 -0.03 -0.69 0.24 0.00 0.00 174.94 174.72 2wn8 s VAL 198 N -0.93 0.21 -0.24 8.37 1.01 -0.11 -5.00 120.40 123.71 2wn8 s VAL 198 Ca 0.13 -0.59 -0.17 0.00 0.00 0.00 0.00 61.98 61.34 2wn8 s VAL 198 Cb -0.10 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 35.97 2wn8 s VAL 198 CO 0.04 -0.25 0.47 -0.60 0.00 0.00 0.00 175.10 174.77 2wn8 s ARG 199 N -0.88 4.10 0.29 2.72 3.52 -1.26 -0.89 118.95 126.55 2wn8 s ARG 199 Ca -0.08 0.27 0.11 0.00 -0.13 0.00 0.00 55.73 55.90 2wn8 s ARG 199 Cb -0.06 -3.62 -0.05 0.00 -1.56 0.00 0.00 34.95 29.66 2wn8 s ARG 199 CO -0.00 -0.25 -0.11 0.96 -0.81 0.00 0.00 175.30 175.09 2wn8 s ILE 200 N 1.98 2.75 -0.08 4.11 -4.36 -0.69 -4.97 121.20 119.94 2wn8 s ILE 200 Ca 0.20 -2.19 0.02 0.00 -0.26 0.00 0.00 60.65 58.42 2wn8 s ILE 200 Cb -0.15 -2.55 0.01 0.00 1.25 0.00 0.00 42.46 41.01 2wn8 s ILE 200 CO 0.09 -0.35 -0.13 -0.69 0.24 0.00 0.00 174.94 174.10 2wn8 s VAL 201 N -2.47 1.26 -0.13 8.37 1.01 -1.26 -0.41 120.40 126.77 2wn8 s VAL 201 Ca 0.31 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 2wn8 s VAL 201 Cb -0.04 -1.16 0.03 0.00 0.00 0.00 0.00 36.38 35.22 2wn8 s VAL 201 CO 0.17 0.39 -0.05 -0.63 0.00 0.00 0.00 175.10 174.98 2wn8 s ILE 202 N 0.81 0.94 -1.51 2.22 1.01 0.19 -4.83 121.20 120.03 2wn8 s ILE 202 Ca -0.11 -0.39 -0.13 0.00 0.00 0.00 0.00 60.65 60.02 2wn8 s ILE 202 Cb -0.15 -1.08 0.07 0.00 0.01 0.00 0.00 42.46 41.31 2wn8 s ILE 202 CO 0.02 0.22 0.99 -0.67 0.00 0.00 0.00 174.94 175.49 2wn8 n ASP 203 N 4.95 -4.74 0.00 3.58 2.03 -1.26 -1.00 116.55 120.11 2wn8 n ASP 203 Ca -0.11 -0.76 0.00 0.00 0.52 0.00 0.00 54.79 54.44 2wn8 n ASP 203 Cb 0.49 -3.99 0.00 0.00 -0.72 0.00 0.00 41.12 36.90 2wn8 n ASP 203 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2wn8 n GLY 204 N -1.72 3.08 3.74 0.27 0.00 -1.26 -5.01 105.19 104.30 2wn8 n GLY 204 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2wn8 n GLY 204 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wn8 s LYS 205 N -0.22 4.47 0.09 1.61 1.02 -0.17 -4.79 119.74 121.76 2wn8 s LYS 205 Ca 0.00 1.02 -0.18 0.00 0.02 0.00 0.00 55.97 56.84 2wn8 s LYS 205 Cb 0.00 -3.37 -0.07 0.00 -0.52 0.00 0.00 37.83 33.87 2wn8 s LYS 205 CO 0.00 0.27 0.55 -1.01 -0.92 0.00 0.00 175.35 174.24 2wn8 s HIS 206 N 0.01 3.74 0.14 3.18 3.76 0.31 -0.63 115.29 125.80 2wn8 s HIS 206 Ca 0.38 1.19 0.05 0.00 -0.15 0.00 0.00 55.06 56.53 2wn8 s HIS 206 Cb -0.20 -2.45 -0.04 0.00 1.11 0.00 0.00 32.58 31.00 2wn8 s HIS 206 CO 0.22 0.54 -0.11 0.71 -0.85 0.00 0.00 174.74 175.26 2wn8 s TYR 207 N -1.22 1.27 -0.28 1.40 2.02 0.45 -4.80 117.35 116.20 2wn8 s TYR 207 Ca 0.31 -0.72 -0.15 0.00 -0.37 0.00 0.00 57.07 56.14 2wn8 s TYR 207 Cb -0.18 -0.65 -0.03 0.00 -0.40 0.00 0.00 41.96 40.70 2wn8 s TYR 207 CO 0.19 0.09 0.39 0.42 -1.57 0.00 0.00 175.55 175.07 2wn8 s ILE 208 N -3.09 5.16 -0.20 2.71 1.01 0.52 -1.71 121.20 125.61 2wn8 s ILE 208 Ca 0.15 0.56 -0.14 0.00 0.00 0.00 0.00 60.65 61.22 2wn8 s ILE 208 Cb 0.01 -3.73 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 2wn8 s ILE 208 CO 0.01 0.12 0.32 -0.75 0.00 0.00 0.00 174.94 174.64 2wn8 s LYS 209 N 2.11 4.17 -0.27 2.79 2.20 -0.07 -0.10 119.74 130.58 2wn8 s LYS 209 Ca 0.16 0.07 -0.03 0.00 -0.36 0.00 0.00 55.97 55.81 2wn8 s LYS 209 Cb -0.16 -3.51 0.02 0.00 -1.51 0.00 0.00 37.83 32.68 2wn8 s LYS 209 CO 0.10 0.05 -0.01 0.00 -0.36 0.00 0.00 175.35 175.13 2wn8 s ALA 210 N 1.04 2.82 -0.35 3.13 0.00 -0.18 -0.94 121.76 127.29 2wn8 s ALA 210 Ca 0.16 -1.51 -0.29 0.00 0.00 0.00 0.00 51.96 50.32 2wn8 s ALA 210 Cb -0.14 -1.86 0.01 0.00 0.00 0.00 0.00 23.12 21.13 2wn8 s ALA 210 CO 0.06 -0.92 1.22 -1.21 0.00 0.00 0.00 175.76 174.92 2wn8 s GLU 211 N 1.36 3.88 0.18 0.00 0.41 0.12 -1.47 118.70 123.18 2wn8 s GLU 211 Ca 0.00 1.04 0.08 0.00 -0.41 0.00 0.00 54.97 55.68 2wn8 s GLU 211 Cb -0.17 -3.86 -0.04 0.00 -1.78 0.00 0.00 34.13 28.27 2wn8 s GLU 211 CO -0.02 -1.16 -0.17 0.00 -0.49 0.00 0.00 175.26 173.42 2wn8 s ALA 212 N 4.31 2.03 0.11 5.21 0.00 -0.66 -0.18 121.76 132.58 2wn8 s ALA 212 Ca 0.52 -1.56 -0.05 0.00 0.00 0.00 0.00 51.96 50.88 2wn8 s ALA 212 Cb -0.13 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 2wn8 s ALA 212 CO 0.24 0.18 0.12 -1.54 0.00 0.00 0.00 175.76 174.76 2wn8 s SER 213 N -2.91 0.24 -0.07 0.00 1.04 -0.31 -1.43 113.70 110.25 2wn8 s SER 213 Ca 0.18 -0.97 -0.16 0.00 0.48 0.00 0.00 55.95 55.49 2wn8 s SER 213 Cb -0.04 0.32 -0.05 0.00 0.10 0.00 0.00 66.02 66.35 2wn8 s SER 213 CO 0.07 -0.75 0.41 -0.69 0.98 0.00 0.00 173.24 173.26 2wn8 s VAL 214 N -3.96 5.14 -0.24 5.02 1.01 -1.25 -1.19 120.40 124.93 2wn8 s VAL 214 Ca 0.15 0.83 -0.07 0.00 0.00 0.00 0.00 61.98 62.89 2wn8 s VAL 214 Cb 0.06 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 2wn8 s VAL 214 CO -0.04 0.45 0.05 -0.69 0.00 0.00 0.00 175.10 174.88 2wn8 s VAL 215 N -0.16 4.18 0.40 2.92 1.01 -0.71 -4.96 120.40 123.09 2wn8 s VAL 215 Ca 0.23 -0.22 -0.26 0.00 0.00 0.00 0.00 61.98 61.74 2wn8 s VAL 215 Cb -0.15 -2.94 -0.09 0.00 0.00 0.00 0.00 36.38 33.20 2wn8 s VAL 215 CO 0.10 0.36 1.26 -0.55 0.00 0.00 0.00 175.10 176.27 2wn8 s SER 216 N 1.52 6.37 -0.08 3.32 0.15 -1.26 -3.90 113.70 119.83 2wn8 s SER 216 Ca 0.06 2.55 -0.20 0.00 0.70 0.00 0.00 55.95 59.06 2wn8 s SER 216 Cb -0.15 -2.63 0.04 0.00 -1.71 0.00 0.00 66.02 61.58 2wn8 s SER 216 CO 0.03 -0.80 0.48 -0.94 1.20 0.00 0.00 173.24 173.21 2wn8 s SER 217 N -0.87 -0.43 -0.05 5.45 1.04 -1.26 -4.68 113.70 112.90 2wn8 s SER 217 Ca 0.57 0.56 -0.30 0.00 0.48 0.00 0.00 55.95 57.26 2wn8 s SER 217 Cb -0.36 0.60 -0.02 0.00 0.10 0.00 0.00 66.02 66.34 2wn8 s SER 217 CO 0.45 -0.41 1.02 -0.22 0.98 0.00 0.00 173.24 175.06 2wn8 s LEU 218 N -0.80 4.30 -0.27 2.42 2.96 0.59 -4.95 118.68 122.93 2wn8 s LEU 218 Ca -0.09 1.62 -0.02 0.00 -0.22 0.00 0.00 54.13 55.43 2wn8 s LEU 218 Cb -0.03 -3.56 0.12 0.00 0.50 0.00 0.00 46.19 43.22 2wn8 s LEU 218 CO 0.05 -0.39 0.27 -0.62 -1.32 0.00 0.00 176.35 174.34 2wn8 s ASP 219 N 1.09 1.73 0.28 3.68 -1.08 -1.26 -0.66 116.67 120.45 2wn8 s ASP 219 Ca 0.51 -0.65 0.25 0.00 -0.52 0.00 0.00 52.55 52.14 2wn8 s ASP 219 Cb -0.20 0.43 0.67 0.00 -1.46 0.00 0.00 42.92 42.36 2wn8 s ASP 219 CO 0.23 -0.38 1.73 -0.26 0.52 0.00 0.00 175.17 177.00 2wn8 h PHE 220 N 8.28 0.00 0.00 -5.34 0.04 -1.83 -3.49 116.94 114.61 2wn8 h PHE 220 Ca -0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.62 2wn8 h PHE 220 Cb 1.09 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.24 2wn8 h PHE 220 CO 0.24 0.00 0.00 1.63 -0.60 0.00 0.00 178.31 179.58 2wn8 n LYS 221 N -2.53 0.00 0.02 1.51 5.02 -1.26 -1.25 118.16 119.68 2wn8 n LYS 221 Ca 0.05 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.45 2wn8 n LYS 221 Cb 0.46 0.00 0.49 0.00 -0.02 0.00 0.00 35.03 35.95 2wn8 n LYS 221 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2wn8 n ASP 222 N 4.31 0.15 -4.15 4.39 5.75 -1.26 -1.37 116.55 124.36 2wn8 n ASP 222 Ca 0.00 0.52 -0.43 0.00 -0.01 0.00 0.00 54.79 54.88 2wn8 n ASP 222 Cb 0.00 -0.56 0.00 0.00 -1.03 0.00 0.00 41.12 39.53 2wn8 n ASP 222 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 2wn8 n ASP 223 N -1.65 4.61 0.14 -1.12 -0.08 -0.38 -4.76 116.55 113.32 2wn8 n ASP 223 Ca 0.05 -2.93 0.02 0.00 -1.51 0.00 0.00 54.79 50.43 2wn8 n ASP 223 Cb 0.29 -1.65 0.38 0.00 2.34 0.00 0.00 41.12 42.47 2wn8 n ASP 223 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 2wn8 h VAL 224 N 4.60 1.21 -0.40 5.18 -1.51 -1.83 -1.94 116.25 121.55 2wn8 h VAL 224 Ca 0.47 -0.95 -0.04 0.00 -1.23 0.00 0.00 66.70 64.94 2wn8 h VAL 224 Cb 0.75 1.38 -0.02 0.00 -2.13 0.00 0.00 31.29 31.27 2wn8 h VAL 224 CO 1.61 0.29 0.08 -1.28 -1.23 0.00 0.00 177.57 177.04 2wn8 h SER 225 N 0.15 0.63 -0.57 4.19 0.87 -1.98 0.28 113.55 117.13 2wn8 h SER 225 Ca 0.03 -0.25 -0.08 0.00 -1.23 0.00 0.00 61.79 60.26 2wn8 h SER 225 Cb 0.48 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.25 2wn8 h SER 225 CO 0.03 0.72 0.03 0.11 -0.53 0.00 0.00 176.83 177.19 2wn8 h LYS 226 N 0.52 0.98 -0.48 2.24 1.57 -1.91 -1.08 116.57 118.40 2wn8 h LYS 226 Ca 0.12 -0.30 0.05 0.00 -1.87 0.00 0.00 60.65 58.66 2wn8 h LYS 226 Cb 0.35 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.51 2wn8 h LYS 226 CO 0.01 0.97 0.20 0.78 -0.57 0.00 0.00 179.45 180.84 2wn8 h GLY 227 N 0.87 0.66 1.46 3.86 0.00 -1.12 -1.46 103.07 107.34 2wn8 h GLY 227 Ca 0.16 -0.13 -0.07 0.00 0.00 0.00 0.00 47.33 47.29 2wn8 h GLY 227 CO 0.02 0.05 -0.07 -1.80 0.00 0.00 0.00 176.54 174.75 2wn8 h ASP 228 N 0.40 0.63 -0.67 0.19 3.58 -0.28 -0.31 116.42 119.96 2wn8 h ASP 228 Ca 0.22 -0.16 -0.05 0.00 0.42 0.00 0.00 57.03 57.46 2wn8 h ASP 228 Cb 0.19 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.05 2wn8 h ASP 228 CO -0.20 0.74 0.22 0.28 -2.88 0.00 0.00 179.24 177.40 2wn8 h SER 229 N 0.60 0.97 -0.05 2.28 0.02 -0.72 -1.12 113.55 115.54 2wn8 h SER 229 Ca 0.11 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2wn8 h SER 229 Cb 0.48 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 2wn8 h SER 229 CO 0.03 0.91 0.02 -0.25 -1.14 0.00 0.00 176.83 176.40 2wn8 h TRP 230 N 0.98 0.07 -0.46 3.45 7.01 -0.82 -1.91 115.95 124.26 2wn8 h TRP 230 Ca 0.22 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.25 2wn8 h TRP 230 Cb 0.28 -0.02 -0.04 0.00 -2.10 0.00 0.00 29.16 27.28 2wn8 h TRP 230 CO 0.02 0.20 0.22 0.78 -2.79 0.00 0.00 178.44 176.87 2wn8 h GLY 231 N -0.08 0.63 1.06 2.65 0.00 -0.88 -0.67 103.07 105.79 2wn8 h GLY 231 Ca 0.02 -0.15 -0.07 0.00 0.00 0.00 0.00 47.33 47.12 2wn8 h GLY 231 CO -0.00 0.10 0.15 0.50 0.00 0.00 0.00 176.54 177.29 2wn8 h LYS 232 N 0.44 1.12 -0.62 4.80 1.57 -1.22 -1.24 116.57 121.42 2wn8 h LYS 232 Ca 0.20 -0.28 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 2wn8 h LYS 232 Cb 0.12 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 2wn8 h LYS 232 CO -0.15 1.00 0.24 0.00 -0.57 0.00 0.00 179.45 179.96 2wn8 h ALA 233 N 1.07 1.24 0.00 3.86 0.00 -0.62 -0.04 119.26 124.78 2wn8 h ALA 233 Ca 0.22 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2wn8 h ALA 233 Cb 0.39 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2wn8 h ALA 233 CO 0.01 0.55 -0.70 0.09 0.00 0.00 0.00 179.25 179.20 2wn8 n ASN 234 N -4.31 0.62 0.00 0.00 3.02 -0.33 -4.40 115.26 109.87 2wn8 n ASN 234 Ca 0.05 -0.33 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 2wn8 n ASN 234 Cb 0.18 0.47 0.00 0.00 -0.61 0.00 0.00 39.78 39.82 2wn8 n ASN 234 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2wn8 n TYR 235 N -1.65 0.00 0.26 3.10 4.01 -0.48 -4.82 117.16 117.58 2wn8 n TYR 235 Ca 0.04 -0.14 0.10 0.00 -0.16 0.00 0.00 57.90 57.74 2wn8 n TYR 235 Cb 0.36 -0.01 0.70 0.00 -0.31 0.00 0.00 39.34 40.08 2wn8 n TYR 235 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 2wn8 h ASN 236 N 0.00 0.00 -0.01 7.72 2.35 -1.21 -2.86 115.58 121.57 2wn8 h ASN 236 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2wn8 h ASN 236 Cb 0.83 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.20 2wn8 h ASN 236 CO 0.00 0.07 -0.20 -0.90 -1.65 0.00 0.00 177.43 174.75 2wn8 n ASP 237 N -4.12 1.68 -0.22 5.81 5.68 -1.26 -4.56 116.55 119.57 2wn8 n ASP 237 Ca -0.03 -1.34 -0.02 0.00 -0.50 0.00 0.00 54.79 52.90 2wn8 n ASP 237 Cb 0.15 0.33 0.09 0.00 -1.14 0.00 0.00 41.12 40.56 2wn8 n ASP 237 CO 0.00 0.00 0.00 -0.25 -1.33 0.00 0.00 177.20 175.62 2wn8 h TRP 238 N 1.92 0.62 -0.65 2.11 7.01 -1.82 -1.80 115.95 123.34 2wn8 h TRP 238 Ca 0.00 0.02 0.12 0.00 2.11 0.00 0.00 58.89 61.15 2wn8 h TRP 238 Cb 0.51 -0.19 -0.09 0.00 -2.10 0.00 0.00 29.16 27.29 2wn8 h TRP 238 CO 0.00 0.29 0.18 1.03 -2.79 0.00 0.00 178.44 177.15 2wn8 h SER 239 N 0.63 0.08 0.56 2.65 0.87 -1.80 -0.27 113.55 116.27 2wn8 h SER 239 Ca 0.28 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.96 2wn8 h SER 239 Cb 0.19 0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 2wn8 h SER 239 CO -0.18 0.03 0.00 0.78 -0.53 0.00 0.00 176.83 176.93 2wn8 h ASN 240 N 0.31 0.00 0.65 6.23 2.35 -1.64 -2.32 115.58 121.16 2wn8 h ASN 240 Ca 0.35 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.10 2wn8 h ASN 240 Cb 0.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.89 2wn8 h ASN 240 CO -0.41 0.00 -0.62 0.29 -1.65 0.00 0.00 177.43 175.04 2wn8 n LYS 241 N -2.76 0.17 -2.85 0.81 5.02 -0.14 -4.90 118.16 113.50 2wn8 n LYS 241 Ca -0.00 0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 56.00 2wn8 n LYS 241 Cb 0.19 -1.59 -0.05 0.00 -0.02 0.00 0.00 35.03 33.56 2wn8 n LYS 241 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wn8 s LEU 242 N -3.66 3.90 0.68 -0.35 1.43 -0.88 -5.08 118.68 114.73 2wn8 s LEU 242 Ca 0.08 1.43 -0.12 0.00 -1.03 0.00 0.00 54.13 54.49 2wn8 s LEU 242 Cb 0.15 -4.29 0.00 0.00 0.03 0.00 0.00 46.19 42.09 2wn8 s LEU 242 CO 0.72 -0.36 1.06 0.42 0.23 0.00 0.00 176.35 178.42 2wn8 s THR 243 N -2.24 3.92 0.23 5.49 -4.23 -1.26 -4.84 115.64 112.71 2wn8 s THR 243 Ca 0.57 0.67 -0.06 0.00 -1.18 0.00 0.00 61.69 61.69 2wn8 s THR 243 Cb -0.10 -3.35 0.18 0.00 1.34 0.00 0.00 72.50 70.57 2wn8 s THR 243 CO 0.21 -0.77 1.77 -0.65 -0.54 0.00 0.00 174.62 174.65 2wn8 h PRO 244 N -0.54 0.57 -0.63 3.99 0.11 -1.98 0.14 132.00 133.66 2wn8 h PRO 244 Ca -0.44 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 65.70 2wn8 h PRO 244 Cb 1.21 -0.13 -0.06 0.00 0.11 0.00 0.00 31.00 32.14 2wn8 h PRO 244 CO 0.56 0.38 0.32 -0.91 -0.21 0.00 0.00 178.00 178.14 2wn8 h ASN 245 N 0.59 0.44 -0.07 -2.05 2.35 -1.99 -0.58 115.58 114.26 2wn8 h ASN 245 Ca 0.36 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 56.14 2wn8 h ASN 245 Cb 0.40 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.73 2wn8 h ASN 245 CO -0.28 0.28 0.01 -0.33 -1.65 0.00 0.00 177.43 175.46 2wn8 h GLU 246 N 0.58 0.11 -0.59 0.81 5.08 -1.69 -2.30 114.58 116.59 2wn8 h GLU 246 Ca 0.29 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.67 2wn8 h GLU 246 Cb 0.24 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.43 2wn8 h GLU 246 CO -0.21 0.31 0.32 1.25 -1.00 0.00 0.00 179.01 179.68 2wn8 h LEU 247 N -0.11 0.48 -0.77 1.33 5.85 -0.77 0.51 115.31 121.82 2wn8 h LEU 247 Ca 0.02 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.79 2wn8 h LEU 247 Cb 0.25 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 2wn8 h LEU 247 CO 0.00 0.32 0.50 0.00 -0.34 0.00 0.00 178.44 178.92 2wn8 h ALA 248 N 1.30 1.00 -0.02 1.25 0.00 -1.04 -0.80 119.26 120.95 2wn8 h ALA 248 Ca 0.26 -0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.90 2wn8 h ALA 248 Cb 0.14 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.65 2wn8 h ALA 248 CO -0.16 0.34 -0.92 -0.44 0.00 0.00 0.00 179.25 178.07 2wn8 h ASP 249 N 1.00 0.62 -0.49 0.00 3.32 -0.85 -1.47 116.42 118.55 2wn8 h ASP 249 Ca 0.30 -0.48 -0.02 0.00 0.02 0.00 0.00 57.03 56.85 2wn8 h ASP 249 Cb -0.05 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 2wn8 h ASP 249 CO -0.09 1.27 0.23 0.58 -1.72 0.00 0.00 179.24 179.51 2wn8 h VAL 250 N 0.28 1.19 -0.41 -1.35 2.07 -0.81 -1.63 116.25 115.59 2wn8 h VAL 250 Ca -0.08 -0.56 0.05 0.00 0.82 0.00 0.00 66.70 66.93 2wn8 h VAL 250 Cb 1.56 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 2wn8 h VAL 250 CO 0.17 0.22 0.16 0.78 0.02 0.00 0.00 177.57 178.91 2wn8 h ASN 251 N 0.65 0.19 -0.78 0.57 2.35 -1.06 -1.96 115.58 115.54 2wn8 h ASN 251 Ca 0.17 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.93 2wn8 h ASN 251 Cb 0.13 0.02 -0.04 0.00 0.05 0.00 0.00 38.32 38.48 2wn8 h ASN 251 CO -0.02 0.15 0.40 0.44 -1.65 0.00 0.00 177.43 176.74 2wn8 h ASP 252 N 0.33 1.00 0.14 5.81 3.32 -1.07 -1.73 116.42 124.23 2wn8 h ASP 252 Ca 0.19 -0.12 0.01 0.00 0.02 0.00 0.00 57.03 57.13 2wn8 h ASP 252 Cb 0.16 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 2wn8 h ASP 252 CO -0.18 0.84 -0.20 0.22 -1.72 0.00 0.00 179.24 178.19 2wn8 h TYR 253 N 1.09 -0.54 -0.30 4.55 3.20 -1.04 -0.46 116.97 123.47 2wn8 h TYR 253 Ca 0.27 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 2wn8 h TYR 253 Cb 0.08 0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 2wn8 h TYR 253 CO 0.01 -0.30 0.13 0.52 -1.64 0.00 0.00 178.16 176.88 2wn8 h MET 254 N -0.41 0.42 -0.05 1.82 2.86 -1.05 -2.37 114.93 116.15 2wn8 h MET 254 Ca 0.02 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2wn8 h MET 254 Cb 0.41 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2wn8 h MET 254 CO -0.09 0.34 0.00 0.54 1.06 0.00 0.00 176.91 178.76 2wn8 n ARG 255 N -4.42 1.12 0.00 1.72 1.74 -0.68 -4.81 116.66 111.33 2wn8 n ARG 255 Ca 0.01 -0.19 0.00 0.00 -0.77 0.00 0.00 57.85 56.91 2wn8 n ARG 255 Cb 0.12 -1.10 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 2wn8 n ARG 255 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wn8 n GLY 256 N 0.64 1.26 0.07 -0.13 0.00 -0.92 -4.97 105.19 101.14 2wn8 n GLY 256 Ca 0.05 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.14 2wn8 n GLY 256 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wn8 n GLY 257 N -0.20 -0.92 0.21 -0.02 0.00 -0.19 -3.00 105.19 101.06 2wn8 n GLY 257 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 46.02 46.09 2wn8 n GLY 257 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2wn8 h TYR 258 N 0.00 0.18 0.37 1.61 -0.00 -1.68 -2.38 116.97 115.07 2wn8 h TYR 258 Ca 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 58.73 58.68 2wn8 h TYR 258 Cb 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 36.73 36.85 2wn8 h TYR 258 CO 0.00 0.44 -0.18 1.15 -0.00 0.00 0.00 178.16 179.57 2wn8 h THR 259 N 0.15 0.64 -0.52 -0.90 2.02 -1.86 0.20 112.91 112.65 2wn8 h THR 259 Ca 0.02 -0.13 0.03 0.00 0.77 0.00 0.00 66.41 67.11 2wn8 h THR 259 Cb 0.58 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 2wn8 h THR 259 CO 0.04 0.03 0.29 0.00 0.37 0.00 0.00 175.52 176.25 2wn8 h ALA 260 N 0.04 0.67 -0.27 6.16 0.00 -1.75 -0.24 119.26 123.88 2wn8 h ALA 260 Ca -0.05 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2wn8 h ALA 260 Cb 0.42 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2wn8 h ALA 260 CO 0.08 -0.03 0.02 0.82 0.00 0.00 0.00 179.25 180.15 2wn8 h ILE 261 N 0.57 1.24 0.03 0.00 2.04 -1.28 -2.00 117.51 118.12 2wn8 h ILE 261 Ca 0.22 -0.86 -0.24 0.00 1.00 0.00 0.00 64.86 64.99 2wn8 h ILE 261 Cb 0.08 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2wn8 h ILE 261 CO -0.13 0.27 -1.00 0.78 0.00 0.00 0.00 178.15 178.07 2wn8 h ASN 262 N 0.25 0.52 -0.79 1.72 2.35 -0.50 -1.81 115.58 117.33 2wn8 h ASN 262 Ca 0.08 -0.44 -0.02 0.00 -0.55 0.00 0.00 56.30 55.36 2wn8 h ASN 262 Cb 0.38 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.55 2wn8 h ASN 262 CO 0.01 1.26 0.40 0.78 -1.65 0.00 0.00 177.43 178.23 2wn8 h ASN 263 N 0.20 1.02 -0.52 5.81 2.35 -1.06 0.47 115.58 123.85 2wn8 h ASN 263 Ca -0.09 -0.11 -0.07 0.00 -0.55 0.00 0.00 56.30 55.48 2wn8 h ASN 263 Cb 1.65 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 39.74 2wn8 h ASN 263 CO 0.17 0.85 0.06 0.22 -1.65 0.00 0.00 177.43 177.08 2wn8 h TYR 264 N 1.13 0.95 -0.23 1.19 3.20 -1.30 -2.23 116.97 119.67 2wn8 h TYR 264 Ca 0.28 -0.14 -0.13 0.00 3.14 0.00 0.00 58.73 61.88 2wn8 h TYR 264 Cb 0.08 -0.26 -0.00 0.00 1.54 0.00 0.00 36.73 38.10 2wn8 h TYR 264 CO 0.01 0.86 -0.35 -0.07 -1.64 0.00 0.00 178.16 176.96 2wn8 h LEU 265 N 0.76 0.71 -0.86 2.82 3.38 -1.07 0.88 115.31 121.93 2wn8 h LEU 265 Ca 0.16 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.60 2wn8 h LEU 265 Cb 0.44 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 2wn8 h LEU 265 CO 0.01 1.09 0.53 0.40 0.09 0.00 0.00 178.44 180.56 2wn8 h ILE 266 N 0.35 1.24 -0.01 1.22 2.04 -0.91 -2.34 117.51 119.10 2wn8 h ILE 266 Ca 0.02 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.38 2wn8 h ILE 266 Cb 0.94 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 2wn8 h ILE 266 CO 0.08 0.24 0.00 -1.54 0.00 0.00 0.00 178.15 176.94 2wn8 n SER 267 N -4.43 0.08 -2.45 1.72 3.41 -0.84 -4.87 113.62 106.23 2wn8 n SER 267 Ca 0.09 -1.55 -0.20 0.00 -0.26 0.00 0.00 58.87 56.95 2wn8 n SER 267 Cb 0.05 -0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.01 2wn8 n SER 267 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2wn8 n ASN 268 N -0.68 -5.59 -0.26 4.04 5.15 -0.88 -4.86 115.26 112.17 2wn8 n ASN 268 Ca 0.11 -0.14 0.07 0.00 -0.60 0.00 0.00 54.58 54.03 2wn8 n ASN 268 Cb 0.06 -4.53 0.21 0.00 -0.53 0.00 0.00 39.78 34.99 2wn8 n ASN 268 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 2wn8 h GLY 269 N -0.64 1.14 1.02 8.20 0.00 -1.04 -1.54 103.07 110.22 2wn8 h GLY 269 Ca -0.47 -0.06 0.09 0.00 0.00 0.00 0.00 47.33 46.89 2wn8 h GLY 269 CO 0.52 -0.22 0.41 -2.55 0.00 0.00 0.00 176.54 174.70 2wn8 h PRO 270 N 0.29 0.00 0.00 4.80 0.11 -1.80 0.19 132.00 135.59 2wn8 h PRO 270 Ca 0.45 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.50 2wn8 h PRO 270 Cb 0.80 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.90 2wn8 h PRO 270 CO -0.53 0.00 -0.91 0.28 -0.21 0.00 0.00 178.00 176.63 2wn8 n VAL 271 N -3.52 1.47 0.85 3.15 0.31 -0.63 -4.40 118.33 115.56 2wn8 n VAL 271 Ca 0.05 0.12 0.12 0.00 -0.01 0.00 0.00 64.34 64.62 2wn8 n VAL 271 Cb 0.55 -2.31 0.25 0.00 -0.91 0.00 0.00 33.84 31.42 2wn8 n VAL 271 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2wn8 n ASN 272 N -4.52 0.53 -2.76 4.52 0.23 -0.86 -4.48 115.26 107.91 2wn8 n ASN 272 Ca -0.16 -0.07 -0.09 0.00 -0.53 0.00 0.00 54.58 53.73 2wn8 n ASN 272 Cb 0.44 0.18 0.07 0.00 -2.08 0.00 0.00 39.78 38.39 2wn8 n ASN 272 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 2wn8 n ASN 273 N -1.70 -2.42 -4.67 0.53 2.85 0.60 -5.02 115.26 105.42 2wn8 n ASN 273 Ca 0.05 -3.50 -0.44 0.00 -0.11 0.00 0.00 54.58 50.58 2wn8 n ASN 273 Cb 0.37 1.76 -0.02 0.00 1.24 0.00 0.00 39.78 43.13 2wn8 n ASN 273 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 2wn8 n PRO 274 N 0.91 2.02 -3.84 1.20 -0.02 -0.72 -4.56 135.00 130.00 2wn8 n PRO 274 Ca 0.08 0.72 -0.30 0.00 -2.02 0.00 0.00 63.50 61.98 2wn8 n PRO 274 Cb 0.67 -2.34 -0.14 0.00 -0.02 0.00 0.00 33.50 31.66 2wn8 n PRO 274 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2wn8 s ASN 275 N 0.11 4.19 0.53 2.55 3.84 -1.26 -5.01 114.94 119.89 2wn8 s ASN 275 Ca 0.65 -2.16 0.21 0.00 0.21 0.00 0.00 52.86 51.77 2wn8 s ASN 275 Cb -0.63 -1.21 1.37 0.00 -0.55 0.00 0.00 41.25 40.22 2wn8 s ASN 275 CO 0.53 -0.35 2.09 -0.65 -2.79 0.00 0.00 177.10 175.93 2wn8 h PRO 276 N 7.48 0.00 -0.01 0.43 0.11 -1.98 -0.03 132.00 138.00 2wn8 h PRO 276 Ca -0.07 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.03 2wn8 h PRO 276 Cb 0.98 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 2wn8 h PRO 276 CO 0.51 0.00 -0.01 1.49 -0.21 0.00 0.00 178.00 179.78 2wn8 h GLU 277 N 0.00 0.02 -0.59 1.05 4.81 -2.00 -2.53 114.58 115.35 2wn8 h GLU 277 Ca 0.10 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.27 2wn8 h GLU 277 Cb 0.42 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 2wn8 h GLU 277 CO -0.00 0.51 0.17 -0.07 -0.73 0.00 0.00 179.01 178.89 2wn8 h LEU 278 N -0.47 0.84 -1.17 1.64 4.07 -1.83 -2.49 115.31 115.90 2wn8 h LEU 278 Ca 0.00 -0.14 -0.00 0.00 0.08 0.00 0.00 57.88 57.82 2wn8 h LEU 278 Cb 0.51 -0.22 -0.04 0.00 1.08 0.00 0.00 40.66 41.99 2wn8 h LEU 278 CO 0.00 0.80 0.47 0.44 -1.08 0.00 0.00 178.44 179.08 2wn8 h ASP 279 N 0.87 0.92 -0.07 -0.43 3.32 -1.05 -1.48 116.42 118.51 2wn8 h ASP 279 Ca 0.19 -0.05 -0.15 0.00 0.02 0.00 0.00 57.03 57.05 2wn8 h ASP 279 Cb 0.27 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2wn8 h ASP 279 CO -0.01 0.70 -0.48 0.28 -1.72 0.00 0.00 179.24 178.01 2wn8 h SER 280 N 1.06 0.68 -0.35 6.45 0.02 -1.15 -1.74 113.55 118.52 2wn8 h SER 280 Ca 0.28 -0.34 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 2wn8 h SER 280 Cb -0.06 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.27 2wn8 h SER 280 CO -0.05 1.05 0.13 0.11 -1.14 0.00 0.00 176.83 176.93 2wn8 h LYS 281 N 0.50 0.53 -0.34 3.45 1.57 -1.15 -2.19 116.57 118.94 2wn8 h LYS 281 Ca 0.03 -0.10 0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2wn8 h LYS 281 Cb 1.02 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.22 2wn8 h LYS 281 CO 0.10 0.54 0.18 0.82 -0.57 0.00 0.00 179.45 180.52 2wn8 h ILE 282 N 0.42 1.01 -0.52 1.86 2.04 -1.20 -0.71 117.51 120.40 2wn8 h ILE 282 Ca 0.12 -0.13 0.04 0.00 1.00 0.00 0.00 64.86 65.88 2wn8 h ILE 282 Cb 0.21 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 2wn8 h ILE 282 CO -0.01 0.07 0.29 0.74 0.00 0.00 0.00 178.15 179.24 2wn8 h THR 283 N 0.38 1.00 -0.69 -0.27 2.02 -1.27 -0.64 112.91 113.44 2wn8 h THR 283 Ca 0.14 -0.20 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 2wn8 h THR 283 Cb 0.03 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 2wn8 h THR 283 CO -0.08 0.10 0.30 0.78 0.37 0.00 0.00 175.52 176.99 2wn8 h ASN 284 N 0.57 0.93 -0.08 4.18 2.35 -0.99 -1.20 115.58 121.33 2wn8 h ASN 284 Ca 0.22 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 2wn8 h ASN 284 Cb 0.08 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.21 2wn8 h ASN 284 CO -0.13 0.83 -0.01 0.40 -1.65 0.00 0.00 177.43 176.87 2wn8 h ILE 285 N 0.97 1.28 -0.64 2.81 2.04 -0.94 -1.52 117.51 121.51 2wn8 h ILE 285 Ca 0.23 -0.89 0.13 0.00 1.00 0.00 0.00 64.86 65.33 2wn8 h ILE 285 Cb 0.17 1.72 -0.10 0.00 -0.74 0.00 0.00 36.82 37.87 2wn8 h ILE 285 CO -0.02 0.25 0.08 -0.08 0.00 0.00 0.00 178.15 178.38 2wn8 h GLU 286 N -0.17 0.19 -0.66 2.37 4.81 -1.02 -1.08 114.58 119.01 2wn8 h GLU 286 Ca 0.02 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 2wn8 h GLU 286 Cb 0.40 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 2wn8 h GLU 286 CO 0.01 0.13 0.16 -0.91 -0.73 0.00 0.00 179.01 177.67 2wn8 h ASN 287 N 0.20 0.98 -0.96 1.04 2.35 -1.06 -2.36 115.58 115.77 2wn8 h ASN 287 Ca 0.34 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2wn8 h ASN 287 Cb 0.55 -0.26 -0.05 0.00 0.05 0.00 0.00 38.32 38.62 2wn8 h ASN 287 CO -0.48 0.94 0.61 0.00 -1.65 0.00 0.00 177.43 176.84 2wn8 h ALA 288 N 1.18 1.22 0.00 -0.83 0.00 -0.50 -2.36 119.26 117.97 2wn8 h ALA 288 Ca 0.21 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2wn8 h ALA 288 Cb 0.34 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2wn8 h ALA 288 CO 0.00 0.65 -0.25 -0.07 0.00 0.00 0.00 179.25 179.57 2wn8 h LEU 289 N 1.31 0.00 0.00 0.00 3.38 -0.88 -2.76 115.31 116.37 2wn8 h LEU 289 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2wn8 h LEU 289 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2wn8 h LEU 289 CO -0.07 0.25 -0.42 0.29 0.09 0.00 0.00 178.44 178.58 2wn8 n LYS 290 N -3.41 0.17 -0.12 1.13 5.02 -0.92 -0.87 118.16 119.15 2wn8 n LYS 290 Ca 0.00 0.07 -0.11 0.00 -2.02 0.00 0.00 58.31 56.25 2wn8 n LYS 290 Cb 0.45 -1.63 -0.02 0.00 -0.02 0.00 0.00 35.03 33.81 2wn8 n LYS 290 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2wn8 h ARG 291 N 0.00 0.65 -2.79 1.97 9.65 -1.12 -3.37 114.38 119.36 2wn8 h ARG 291 Ca 0.00 -0.21 -0.61 0.00 -1.10 0.00 0.00 59.98 58.06 2wn8 h ARG 291 Cb 0.65 -0.05 -0.40 0.00 -1.39 0.00 0.00 29.97 28.77 2wn8 h ARG 291 CO 0.00 0.77 -0.78 -2.00 2.80 0.00 0.00 179.97 180.76 2wn8 s GLU 292 N -4.96 1.44 0.57 0.20 2.56 -1.26 -5.12 118.70 112.12 2wn8 s GLU 292 Ca -0.13 -2.36 -0.21 0.00 0.00 0.00 0.00 54.97 52.28 2wn8 s GLU 292 Cb 0.09 -2.27 -0.04 0.00 2.00 0.00 0.00 34.13 33.91 2wn8 s GLU 292 CO 0.79 -1.27 1.30 -2.30 -0.56 0.00 0.00 175.26 173.22 2wn8 n PRO 293 N 2.93 1.49 -1.62 4.30 -0.02 -1.26 -4.59 135.00 136.24 2wn8 n PRO 293 Ca 0.19 0.56 -0.54 0.00 -2.02 0.00 0.00 63.50 61.68 2wn8 n PRO 293 Cb 0.39 -2.52 -0.07 0.00 -0.02 0.00 0.00 33.50 31.29 2wn8 n PRO 293 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2wn8 n ILE 294 N -1.27 0.31 0.64 4.25 2.08 -0.29 -4.77 119.36 120.30 2wn8 n ILE 294 Ca 0.12 -0.12 0.13 0.00 0.56 0.00 0.00 62.75 63.44 2wn8 n ILE 294 Cb 0.45 -1.43 0.37 0.00 -0.75 0.00 0.00 39.64 38.29 2wn8 n ILE 294 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 2wn8 n PRO 295 N 6.49 0.25 -3.88 0.38 -0.04 -1.26 0.15 135.00 137.10 2wn8 n PRO 295 Ca 0.31 0.18 -0.10 0.00 -0.04 0.00 0.00 63.50 63.85 2wn8 n PRO 295 Cb 0.18 -1.77 -0.09 0.00 -0.04 0.00 0.00 33.50 31.78 2wn8 n PRO 295 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2wn8 s THR 296 N -3.11 0.11 -0.03 0.52 -1.32 -1.26 -4.73 115.64 105.83 2wn8 s THR 296 Ca 0.10 -0.94 -0.35 0.00 -1.21 0.00 0.00 61.69 59.29 2wn8 s THR 296 Cb 0.13 -0.85 -0.13 0.00 -1.51 0.00 0.00 72.50 70.14 2wn8 s THR 296 CO 0.62 -0.52 1.77 0.59 -2.21 0.00 0.00 174.62 174.87 2wn8 n ASN 297 N 0.80 3.21 -3.93 8.08 3.02 -1.26 -4.09 115.26 121.09 2wn8 n ASN 297 Ca -0.19 1.02 -0.18 0.00 -0.03 0.00 0.00 54.58 55.20 2wn8 n ASN 297 Cb 0.58 -1.36 -0.15 0.00 -0.61 0.00 0.00 39.78 38.24 2wn8 n ASN 297 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2wn8 s LEU 298 N 3.05 1.67 -0.22 3.41 2.96 -0.11 -0.30 118.68 129.13 2wn8 s LEU 298 Ca 0.89 -0.10 -0.11 0.00 -0.22 0.00 0.00 54.13 54.59 2wn8 s LEU 298 Cb -0.73 -0.35 -0.05 0.00 0.50 0.00 0.00 46.19 45.57 2wn8 s LEU 298 CO 0.49 0.01 0.17 -0.89 -1.32 0.00 0.00 176.35 174.81 2wn8 s THR 299 N 0.36 5.37 0.36 3.68 2.01 0.16 0.91 115.64 128.49 2wn8 s THR 299 Ca -0.04 0.23 0.04 0.00 0.31 0.00 0.00 61.69 62.23 2wn8 s THR 299 Cb -0.08 -3.51 -0.06 0.00 0.01 0.00 0.00 72.50 68.86 2wn8 s THR 299 CO -0.00 0.37 0.05 0.68 -0.69 0.00 0.00 174.62 175.04 2wn8 s VAL 300 N 0.81 1.27 -0.04 3.82 -7.23 0.50 -4.66 120.40 114.86 2wn8 s VAL 300 Ca 0.09 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.26 2wn8 s VAL 300 Cb -0.13 -2.76 0.03 0.00 0.56 0.00 0.00 36.38 34.08 2wn8 s VAL 300 CO 0.02 0.00 -0.02 -0.31 -0.31 0.00 0.00 175.10 174.49 2wn8 s TYR 301 N -3.17 0.54 -0.10 2.82 2.02 0.23 -0.78 117.35 118.91 2wn8 s TYR 301 Ca 0.34 -0.10 0.03 0.00 -0.37 0.00 0.00 57.07 56.97 2wn8 s TYR 301 Cb 0.08 -0.58 -0.01 0.00 -0.40 0.00 0.00 41.96 41.05 2wn8 s TYR 301 CO 0.15 -0.19 -0.21 0.50 -1.57 0.00 0.00 175.55 174.23 2wn8 s ARG 302 N 1.19 3.02 -0.43 -0.62 3.52 0.15 0.17 118.95 125.93 2wn8 s ARG 302 Ca -0.07 -0.82 -0.22 0.00 -0.13 0.00 0.00 55.73 54.48 2wn8 s ARG 302 Cb -0.14 -2.36 0.02 0.00 -1.56 0.00 0.00 34.95 30.91 2wn8 s ARG 302 CO -0.02 0.25 0.71 1.03 -0.81 0.00 0.00 175.30 176.46 2wn8 s ARG 303 N 0.19 3.39 -0.12 5.12 1.81 -1.26 0.57 118.95 128.65 2wn8 s ARG 303 Ca -0.12 -0.19 -0.08 0.00 -1.72 0.00 0.00 55.73 53.61 2wn8 s ARG 303 Cb -0.16 -3.93 -0.04 0.00 -0.45 0.00 0.00 34.95 30.37 2wn8 s ARG 303 CO 0.07 -1.03 0.16 -1.12 -0.68 0.00 0.00 175.30 172.70 2wn8 s SER 304 N 2.04 6.41 0.77 0.23 0.01 0.12 -5.00 113.70 118.27 2wn8 s SER 304 Ca 0.26 0.48 -0.08 0.00 1.31 0.00 0.00 55.95 57.93 2wn8 s SER 304 Cb -0.13 -2.09 0.10 0.00 0.21 0.00 0.00 66.02 64.11 2wn8 s SER 304 CO 0.20 0.37 1.09 -0.83 0.41 0.00 0.00 173.24 174.48 2wn8 s GLY 305 N -0.86 1.71 0.26 3.44 0.00 -1.26 -3.73 107.32 106.88 2wn8 s GLY 305 Ca 0.15 -1.10 -0.03 0.00 0.00 0.00 0.00 44.72 43.74 2wn8 s GLY 305 CO 0.04 -0.58 1.82 -0.56 0.00 0.00 0.00 173.10 173.82 2wn8 h PRO 306 N -0.83 0.95 -0.88 2.90 0.13 -1.89 -3.26 132.00 129.12 2wn8 h PRO 306 Ca -0.43 -0.18 0.09 0.00 -0.87 0.00 0.00 66.00 64.61 2wn8 h PRO 306 Cb 1.29 -0.15 -0.06 0.00 0.13 0.00 0.00 31.00 32.21 2wn8 h PRO 306 CO 0.53 0.81 0.57 1.96 -0.23 0.00 0.00 178.00 181.63 2wn8 h GLN 307 N 0.92 0.87 0.00 0.86 7.50 -1.56 -0.32 115.11 123.37 2wn8 h GLN 307 Ca 0.21 -0.05 -0.00 0.00 0.50 0.00 0.00 58.65 59.30 2wn8 h GLN 307 Cb 0.25 -0.20 -0.00 0.00 0.05 0.00 0.00 27.48 27.58 2wn8 h GLN 307 CO -0.01 0.57 -0.01 0.93 -1.50 0.00 0.00 178.83 178.82 2wn8 h GLU 308 N 0.89 0.00 -0.31 1.46 5.08 -1.84 -1.53 114.58 118.34 2wn8 h GLU 308 Ca 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 2wn8 h GLU 308 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2wn8 h GLU 308 CO -0.16 0.01 0.00 1.19 -1.00 0.00 0.00 179.01 179.04 2wn8 n PHE 309 N -3.27 0.70 -0.70 4.33 3.72 -0.19 -4.97 117.46 117.08 2wn8 n PHE 309 Ca -0.03 -0.67 0.00 0.00 -0.05 0.00 0.00 57.45 56.70 2wn8 n PHE 309 Cb 0.09 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 38.47 2wn8 n PHE 309 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wn8 n GLY 310 N 0.05 0.59 3.56 1.37 0.00 -0.57 -5.06 105.19 105.12 2wn8 n GLY 310 Ca 0.16 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 45.30 2wn8 n GLY 310 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wn8 s LEU 311 N 0.00 3.07 0.74 0.99 1.43 -0.85 -4.98 118.68 119.09 2wn8 s LEU 311 Ca 0.00 -0.10 -0.12 0.00 -1.03 0.00 0.00 54.13 52.88 2wn8 s LEU 311 Cb 0.00 -1.69 0.04 0.00 0.03 0.00 0.00 46.19 44.57 2wn8 s LEU 311 CO 0.00 0.33 1.11 0.42 0.23 0.00 0.00 176.35 178.44 2wn8 s THR 312 N -0.85 3.19 0.58 5.49 -4.23 -1.26 -1.50 115.64 117.05 2wn8 s THR 312 Ca 0.14 0.45 0.27 0.00 -1.18 0.00 0.00 61.69 61.36 2wn8 s THR 312 Cb -0.11 -2.92 0.34 0.00 1.34 0.00 0.00 72.50 71.15 2wn8 s THR 312 CO 0.03 -0.44 2.20 0.25 -0.54 0.00 0.00 174.62 176.11 2wn8 h LEU 313 N -0.74 0.00 -0.95 4.79 6.46 -2.00 -1.56 115.31 121.31 2wn8 h LEU 313 Ca -0.45 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.31 2wn8 h LEU 313 Cb 1.24 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.17 2wn8 h LEU 313 CO 0.52 0.00 -0.23 0.35 -0.62 0.00 0.00 178.44 178.45 2wn8 n THR 314 N -3.97 0.00 -1.66 1.05 -2.24 -1.26 -5.00 114.28 101.20 2wn8 n THR 314 Ca -0.02 -0.25 -0.52 0.00 -2.27 0.00 0.00 64.05 61.00 2wn8 n THR 314 Cb 0.15 0.83 -0.06 0.00 -2.10 0.00 0.00 70.33 69.15 2wn8 n THR 314 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2wn8 n SER 315 N -0.01 2.52 0.00 3.42 7.64 -0.59 -4.86 113.62 121.74 2wn8 n SER 315 Ca 0.13 1.07 0.10 0.00 1.01 0.00 0.00 58.87 61.18 2wn8 n SER 315 Cb 0.42 -1.26 0.55 0.00 -1.01 0.00 0.00 64.21 62.91 2wn8 n SER 315 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2wn8 n PRO 316 N 4.33 0.47 0.03 1.43 -0.04 -1.26 -2.51 135.00 137.45 2wn8 n PRO 316 Ca 0.21 0.05 0.12 0.00 -0.04 0.00 0.00 63.50 63.84 2wn8 n PRO 316 Cb 0.22 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.38 2wn8 n PRO 316 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2wn8 n GLU 317 N -1.13 0.15 0.00 0.54 1.02 -1.26 -3.97 120.64 115.99 2wn8 n GLU 317 Ca 0.12 0.04 0.14 0.00 -0.02 0.00 0.00 57.16 57.44 2wn8 n GLU 317 Cb 0.11 -1.59 0.57 0.00 -0.02 0.00 0.00 31.44 30.51 2wn8 n GLU 317 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2wn8 n TYR 318 N -1.80 0.00 -3.02 -0.32 9.36 -1.04 -4.77 117.16 115.56 2wn8 n TYR 318 Ca 0.04 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.83 2wn8 n TYR 318 Cb 0.39 -0.15 -0.05 0.00 -0.63 0.00 0.00 39.34 38.89 2wn8 n TYR 318 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2wn8 s ASP 319 N -2.42 6.29 0.00 2.98 2.15 -1.25 -4.91 116.67 119.50 2wn8 s ASP 319 Ca 0.29 -0.59 0.25 0.00 0.43 0.00 0.00 52.55 52.94 2wn8 s ASP 319 Cb 0.20 -2.35 0.86 0.00 -0.30 0.00 0.00 42.92 41.33 2wn8 s ASP 319 CO 0.47 -1.00 1.63 0.49 -0.17 0.00 0.00 175.17 176.59 2wn8 n PHE 320 N 6.68 0.08 0.25 -5.34 3.72 -1.26 -3.17 117.46 118.42 2wn8 n PHE 320 Ca -0.02 -0.04 0.09 0.00 -0.05 0.00 0.00 57.45 57.42 2wn8 n PHE 320 Cb 0.47 0.00 0.63 0.00 -0.94 0.00 0.00 39.48 39.64 2wn8 n PHE 320 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 2wn8 h ASN 321 N 2.61 0.00 -3.36 4.37 2.35 -1.91 -3.40 115.58 116.23 2wn8 h ASN 321 Ca 0.00 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.18 2wn8 h ASN 321 Cb 0.56 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.86 2wn8 h ASN 321 CO 0.00 0.11 0.10 -0.54 -1.65 0.00 0.00 177.43 175.45 2wn8 s LYS 322 N -4.65 4.36 0.30 0.81 1.02 -1.19 -4.98 119.74 115.41 2wn8 s LYS 322 Ca -0.04 0.79 0.00 0.00 0.02 0.00 0.00 55.97 56.74 2wn8 s LYS 322 Cb 0.15 -3.49 0.45 0.00 -0.52 0.00 0.00 37.83 34.43 2wn8 s LYS 322 CO 0.65 -0.03 1.85 1.25 -0.92 0.00 0.00 175.35 178.14 2wn8 h LEU 323 N 7.24 0.72 -1.94 3.17 5.85 -1.89 -2.77 115.31 125.69 2wn8 h LEU 323 Ca -0.38 -0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.27 2wn8 h LEU 323 Cb 1.18 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 2wn8 h LEU 323 CO 0.77 0.71 0.15 -0.33 -0.34 0.00 0.00 178.44 179.40 2wn8 h GLU 324 N 0.75 0.08 -0.11 1.25 3.07 -1.94 -1.00 114.58 116.69 2wn8 h GLU 324 Ca 0.17 -0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.87 2wn8 h GLU 324 Cb 0.27 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.16 2wn8 h GLU 324 CO -0.00 0.05 -0.60 -0.91 -1.40 0.00 0.00 179.01 176.15 2wn8 h ASN 325 N 0.08 0.41 -0.14 1.42 -0.26 -1.75 -2.32 115.58 113.02 2wn8 h ASN 325 Ca 0.10 -0.23 -0.03 0.00 -0.56 0.00 0.00 56.30 55.57 2wn8 h ASN 325 Cb 0.30 -0.12 -0.00 0.00 -1.06 0.00 0.00 38.32 37.44 2wn8 h ASN 325 CO -0.01 0.92 -0.04 0.40 -1.06 0.00 0.00 177.43 177.64 2wn8 h ILE 326 N 0.27 1.29 -0.43 2.81 2.04 -1.25 -1.74 117.51 120.50 2wn8 h ILE 326 Ca -0.01 -0.99 0.05 0.00 1.00 0.00 0.00 64.86 64.92 2wn8 h ILE 326 Cb 1.13 1.67 -0.05 0.00 -0.74 0.00 0.00 36.82 38.83 2wn8 h ILE 326 CO 0.10 0.29 0.15 0.44 0.00 0.00 0.00 178.15 179.13 2wn8 h ASP 327 N -0.04 0.16 -0.95 1.72 3.32 -1.34 -0.17 116.42 119.11 2wn8 h ASP 327 Ca 0.03 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2wn8 h ASP 327 Cb 0.46 0.04 -0.05 0.00 0.22 0.00 0.00 39.33 40.00 2wn8 h ASP 327 CO 0.01 0.12 0.59 0.00 -1.72 0.00 0.00 179.24 178.25 2wn8 h ALA 328 N 1.28 1.25 -0.16 3.45 0.00 -1.42 -1.10 119.26 122.56 2wn8 h ALA 328 Ca 0.20 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 2wn8 h ALA 328 Cb 0.20 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2wn8 h ALA 328 CO -0.21 0.66 -0.00 0.35 0.00 0.00 0.00 179.25 180.05 2wn8 h PHE 329 N 1.30 0.32 -0.51 0.00 3.57 -0.56 -1.95 116.94 119.11 2wn8 h PHE 329 Ca 0.34 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 2wn8 h PHE 329 Cb -0.08 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 2wn8 h PHE 329 CO 0.00 0.51 0.30 0.87 -2.23 0.00 0.00 178.31 177.76 2wn8 h LYS 330 N 0.03 0.70 -0.91 1.11 1.57 -0.91 -1.22 116.57 116.94 2wn8 h LYS 330 Ca 0.05 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.80 2wn8 h LYS 330 Cb 0.38 -0.14 -0.06 0.00 0.08 0.00 0.00 32.23 32.50 2wn8 h LYS 330 CO 0.01 0.52 0.59 1.03 -0.57 0.00 0.00 179.45 181.03 2wn8 h SER 331 N 0.68 0.95 -0.14 0.86 0.87 -1.16 0.17 113.55 115.79 2wn8 h SER 331 Ca 0.18 -0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.55 2wn8 h SER 331 Cb 0.01 -0.21 0.01 0.00 -0.44 0.00 0.00 62.40 61.77 2wn8 h SER 331 CO -0.03 0.64 -0.66 0.50 -0.53 0.00 0.00 176.83 176.74 2wn8 h LYS 332 N 1.10 0.69 0.00 2.24 1.63 -1.04 -3.42 116.57 117.76 2wn8 h LYS 332 Ca 0.37 -0.56 -0.12 0.00 -0.85 0.00 0.00 60.65 59.50 2wn8 h LYS 332 Cb 0.09 0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.82 2wn8 h LYS 332 CO -0.13 1.18 -1.43 0.91 -3.45 0.00 0.00 179.45 176.53 2wn8 n TRP 333 N -4.06 0.00 -2.02 1.91 7.02 -0.49 -4.84 117.44 114.96 2wn8 n TRP 333 Ca -0.08 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 55.98 2wn8 n TRP 333 Cb 0.69 -0.31 -0.03 0.00 -2.42 0.00 0.00 31.31 29.24 2wn8 n TRP 333 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2wn8 s GLU 334 N -2.15 4.22 0.00 -0.99 2.12 0.55 -1.30 118.70 121.15 2wn8 s GLU 334 Ca -0.04 2.21 0.00 0.00 0.36 0.00 0.00 54.97 57.50 2wn8 s GLU 334 Cb 0.02 -3.67 0.00 0.00 0.26 0.00 0.00 34.13 30.74 2wn8 s GLU 334 CO 0.25 -0.72 0.00 0.41 -0.54 0.00 0.00 175.26 174.66 2wn8 n GLY 335 N 3.93 0.56 3.71 -1.50 0.00 0.42 -4.91 105.19 107.40 2wn8 n GLY 335 Ca 0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 2wn8 n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wn8 s GLN 336 N -0.02 2.28 0.07 1.61 -1.52 -0.42 -4.89 119.66 116.77 2wn8 s GLN 336 Ca 0.00 -1.64 -0.11 0.00 -1.95 0.00 0.00 55.36 51.66 2wn8 s GLN 336 Cb 0.00 -2.09 -0.06 0.00 -0.22 0.00 0.00 33.01 30.65 2wn8 s GLN 336 CO 0.00 0.08 0.41 0.00 -0.25 0.00 0.00 175.29 175.54 2wn8 s ALA 337 N -2.47 3.71 -0.15 6.09 0.00 -1.26 -1.42 121.76 126.25 2wn8 s ALA 337 Ca 0.37 -0.33 -0.01 0.00 0.00 0.00 0.00 51.96 51.99 2wn8 s ALA 337 Cb -0.01 -2.31 0.04 0.00 0.00 0.00 0.00 23.12 20.84 2wn8 s ALA 337 CO 0.22 0.54 -0.02 -1.17 0.00 0.00 0.00 175.76 175.33 2wn8 s LEU 338 N -1.80 1.30 -0.05 0.00 2.96 0.99 -4.95 118.68 117.13 2wn8 s LEU 338 Ca 0.32 -0.56 -0.09 0.00 -0.22 0.00 0.00 54.13 53.58 2wn8 s LEU 338 Cb -0.14 -0.75 -0.05 0.00 0.50 0.00 0.00 46.19 45.75 2wn8 s LEU 338 CO 0.17 -0.21 0.25 -0.44 -1.32 0.00 0.00 176.35 174.80 2wn8 s SER 339 N 1.75 6.54 -0.24 3.68 0.01 -1.26 -0.32 113.70 123.85 2wn8 s SER 339 Ca 0.01 0.63 -0.04 0.00 1.31 0.00 0.00 55.95 57.87 2wn8 s SER 339 Cb -0.15 -2.13 0.00 0.00 0.21 0.00 0.00 66.02 63.96 2wn8 s SER 339 CO -0.07 0.35 -0.02 -0.31 0.41 0.00 0.00 173.24 173.59 2wn8 s TYR 340 N -1.11 3.02 0.20 2.43 2.02 -0.34 -5.00 117.35 118.57 2wn8 s TYR 340 Ca 0.21 -1.05 -0.08 0.00 -0.37 0.00 0.00 57.07 55.77 2wn8 s TYR 340 Cb -0.14 -2.13 0.11 0.00 -0.40 0.00 0.00 41.96 39.40 2wn8 s TYR 340 CO 0.10 -0.58 1.69 -1.35 -1.57 0.00 0.00 175.55 173.83 2wn8 h PRO 341 N 8.12 1.11 -7.61 -1.71 0.11 -1.88 0.15 132.00 130.29 2wn8 h PRO 341 Ca -0.38 -0.30 -0.47 0.00 0.11 0.00 0.00 66.00 64.96 2wn8 h PRO 341 Cb 1.14 -0.13 0.10 0.00 0.11 0.00 0.00 31.00 32.23 2wn8 h PRO 341 CO 0.60 1.02 0.41 0.54 -0.21 0.00 0.00 178.00 180.36 2wn8 s ASN 342 N -6.52 4.53 0.50 -2.05 4.22 -1.26 -3.38 114.94 110.97 2wn8 s ASN 342 Ca -0.12 0.79 -0.21 0.00 -2.14 0.00 0.00 52.86 51.18 2wn8 s ASN 342 Cb 0.14 -1.29 -0.06 0.00 1.28 0.00 0.00 41.25 41.32 2wn8 s ASN 342 CO 0.85 -1.89 1.17 -0.36 -2.04 0.00 0.00 177.10 174.83 2wn8 s PHE 343 N -3.57 2.73 -0.33 1.54 0.08 -1.26 -3.81 117.98 113.36 2wn8 s PHE 343 Ca 0.62 1.52 -0.05 0.00 0.12 0.00 0.00 56.93 59.15 2wn8 s PHE 343 Cb -0.11 -3.39 0.05 0.00 -0.57 0.00 0.00 43.02 38.99 2wn8 s PHE 343 CO 0.49 -1.68 0.07 0.42 -0.10 0.00 0.00 175.22 174.42 2wn8 s ILE 344 N -1.60 3.48 -0.10 0.64 1.09 -0.69 -4.94 121.20 119.09 2wn8 s ILE 344 Ca 0.68 -1.27 -0.29 0.00 -1.10 0.00 0.00 60.65 58.67 2wn8 s ILE 344 Cb -0.28 -3.00 -0.02 0.00 -1.06 0.00 0.00 42.46 38.10 2wn8 s ILE 344 CO 0.33 -0.18 0.97 -0.55 -0.10 0.00 0.00 174.94 175.41 2wn8 s SER 345 N 1.39 7.21 0.30 3.58 0.15 -1.26 -0.98 113.70 124.09 2wn8 s SER 345 Ca -0.02 1.49 0.03 0.00 0.70 0.00 0.00 55.95 58.14 2wn8 s SER 345 Cb -0.20 -2.54 -0.06 0.00 -1.71 0.00 0.00 66.02 61.52 2wn8 s SER 345 CO 0.01 -0.40 0.08 0.42 1.20 0.00 0.00 173.24 174.55 2wn8 s THR 346 N 1.83 0.91 0.05 6.45 -4.23 0.59 -4.75 115.64 116.49 2wn8 s THR 346 Ca 0.47 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 59.06 2wn8 s THR 346 Cb -0.18 -2.72 -0.03 0.00 1.34 0.00 0.00 72.50 70.90 2wn8 s THR 346 CO 0.19 0.00 -0.20 -0.55 -0.54 0.00 0.00 174.62 173.52 2wn8 s SER 347 N -3.42 3.67 0.03 3.99 0.15 0.13 -0.52 113.70 117.73 2wn8 s SER 347 Ca 0.37 -0.48 0.18 0.00 0.70 0.00 0.00 55.95 56.72 2wn8 s SER 347 Cb 0.08 -0.53 0.76 0.00 -1.71 0.00 0.00 66.02 64.62 2wn8 s SER 347 CO 0.15 0.25 1.57 2.30 1.20 0.00 0.00 173.24 178.71 2wn8 n ILE 348 N 1.52 0.81 -4.34 6.45 -6.64 -0.36 -0.60 119.36 116.20 2wn8 n ILE 348 Ca -0.16 0.19 -0.27 0.00 -1.77 0.00 0.00 62.75 60.75 2wn8 n ILE 348 Cb 0.52 -0.93 -0.10 0.00 -1.44 0.00 0.00 39.64 37.69 2wn8 n ILE 348 CO 0.00 0.00 0.00 -0.83 -1.77 0.00 0.00 176.55 173.95 2wn8 s GLY 349 N -3.07 1.73 0.00 3.28 0.00 -1.26 -4.35 107.32 103.64 2wn8 s GLY 349 Ca 0.08 -1.54 0.21 0.00 0.00 0.00 0.00 44.72 43.47 2wn8 s GLY 349 CO 0.33 -1.57 0.95 -1.14 0.00 0.00 0.00 173.10 171.67 2wn8 n SER 350 N 0.09 1.14 -4.64 1.64 3.41 -0.47 -4.48 113.62 110.31 2wn8 n SER 350 Ca -0.11 -1.06 -0.42 0.00 -0.26 0.00 0.00 58.87 57.02 2wn8 n SER 350 Cb 0.56 0.89 0.00 0.00 -0.26 0.00 0.00 64.21 65.40 2wn8 n SER 350 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2wn8 n VAL 351 N -1.27 2.33 -2.06 -3.33 0.31 -1.07 -4.29 118.33 108.95 2wn8 n VAL 351 Ca 0.05 -0.50 -0.34 0.00 -0.01 0.00 0.00 64.34 63.54 2wn8 n VAL 351 Cb 0.35 -1.30 0.02 0.00 -0.91 0.00 0.00 33.84 32.00 2wn8 n VAL 351 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2wn8 s ASN 352 N -0.59 5.46 0.03 4.52 2.47 -0.86 -4.94 114.94 121.04 2wn8 s ASN 352 Ca 0.61 2.12 0.00 0.00 0.42 0.00 0.00 52.86 56.01 2wn8 s ASN 352 Cb -0.57 -2.57 -0.03 0.00 -1.45 0.00 0.00 41.25 36.64 2wn8 s ASN 352 CO 0.58 -1.39 -0.04 -0.04 -3.72 0.00 0.00 177.10 172.49 2wn8 s MET 353 N -3.59 0.42 0.36 0.43 -1.94 -1.26 -4.41 119.30 109.31 2wn8 s MET 353 Ca 0.71 -0.77 0.09 0.00 -1.71 0.00 0.00 55.69 54.01 2wn8 s MET 353 Cb -0.23 0.06 0.82 0.00 2.01 0.00 0.00 34.83 37.49 2wn8 s MET 353 CO 0.33 -0.05 1.88 0.66 -0.01 0.00 0.00 175.02 177.83 2wn8 h SER 354 N 4.29 0.64 0.00 3.03 4.64 -1.98 0.46 113.55 124.63 2wn8 h SER 354 Ca -0.33 0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2wn8 h SER 354 Cb 1.19 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2wn8 h SER 354 CO 0.46 0.34 -0.00 0.00 -0.87 0.00 0.00 176.83 176.76 2wn8 h ALA 355 N 1.60 1.57 -0.11 5.18 0.00 -2.03 -2.52 119.26 122.95 2wn8 h ALA 355 Ca 0.43 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.30 2wn8 h ALA 355 Cb 0.67 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2wn8 h ALA 355 CO -0.19 0.00 -0.18 1.19 0.00 0.00 0.00 179.25 180.08 2wn8 n PHE 356 N -3.91 0.35 -0.12 0.00 3.01 0.12 -4.85 117.46 112.05 2wn8 n PHE 356 Ca -0.03 -1.26 0.02 0.00 1.01 0.00 0.00 57.45 57.19 2wn8 n PHE 356 Cb 0.08 -0.27 0.32 0.00 -0.01 0.00 0.00 39.48 39.60 2wn8 n PHE 356 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wn8 h ALA 357 N 0.77 1.56 0.00 4.37 0.00 -1.06 -2.62 119.26 122.28 2wn8 h ALA 357 Ca 0.04 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 2wn8 h ALA 357 Cb 1.19 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 2wn8 h ALA 357 CO 0.11 0.40 -0.84 1.57 0.00 0.00 0.00 179.25 180.49 2wn8 h LYS 358 N 0.81 0.00 -6.87 0.00 -0.00 -1.88 -3.47 116.57 105.16 2wn8 h LYS 358 Ca 0.22 0.00 -0.53 0.00 -0.00 0.00 0.00 60.65 60.34 2wn8 h LYS 358 Cb -0.08 0.00 0.08 0.00 -0.00 0.00 0.00 32.23 32.23 2wn8 h LYS 358 CO -0.05 0.64 0.75 1.03 -0.00 0.00 0.00 179.45 181.83 2wn8 s ARG 359 N -2.85 4.21 0.00 0.07 0.52 -0.99 -4.93 118.95 114.98 2wn8 s ARG 359 Ca 0.02 2.42 0.13 0.00 -0.52 0.00 0.00 55.73 57.78 2wn8 s ARG 359 Cb 0.08 -3.03 0.23 0.00 0.52 0.00 0.00 34.95 32.75 2wn8 s ARG 359 CO 0.78 -0.43 1.11 1.63 0.02 0.00 0.00 175.30 178.40 2wn8 n LYS 360 N 1.20 1.81 -3.87 3.54 5.02 -1.26 -4.92 118.16 119.68 2wn8 n LYS 360 Ca 0.03 -1.71 -0.24 0.00 -2.02 0.00 0.00 58.31 54.37 2wn8 n LYS 360 Cb 0.40 -1.29 -0.17 0.00 -0.02 0.00 0.00 35.03 33.95 2wn8 n LYS 360 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wn8 s ILE 361 N -1.06 0.69 -0.34 -0.18 1.01 -1.24 -0.75 121.20 119.33 2wn8 s ILE 361 Ca 0.21 -0.09 -0.12 0.00 0.00 0.00 0.00 60.65 60.66 2wn8 s ILE 361 Cb 0.13 -0.77 -0.01 0.00 0.01 0.00 0.00 42.46 41.81 2wn8 s ILE 361 CO 0.18 0.31 0.22 -0.69 0.00 0.00 0.00 174.94 174.96 2wn8 s VAL 362 N 1.76 5.07 -0.46 2.92 1.01 0.68 0.11 120.40 131.49 2wn8 s VAL 362 Ca 0.04 -0.34 -0.19 0.00 0.00 0.00 0.00 61.98 61.49 2wn8 s VAL 362 Cb -0.13 -3.63 0.03 0.00 0.00 0.00 0.00 36.38 32.66 2wn8 s VAL 362 CO -0.06 -0.02 0.60 -0.22 0.00 0.00 0.00 175.10 175.39 2wn8 s LEU 363 N 1.68 4.72 -0.45 3.92 2.96 0.19 0.22 118.68 131.93 2wn8 s LEU 363 Ca 0.05 -0.59 -0.17 0.00 -0.22 0.00 0.00 54.13 53.20 2wn8 s LEU 363 Cb -0.18 -2.56 0.04 0.00 0.50 0.00 0.00 46.19 43.99 2wn8 s LEU 363 CO 0.09 -0.78 0.43 -0.60 -1.32 0.00 0.00 176.35 174.18 2wn8 s ARG 364 N 2.63 3.04 -0.22 1.98 3.52 0.91 -0.68 118.95 130.13 2wn8 s ARG 364 Ca 0.18 -1.01 -0.04 0.00 -0.13 0.00 0.00 55.73 54.73 2wn8 s ARG 364 Cb -0.16 -4.04 -0.01 0.00 -1.56 0.00 0.00 34.95 29.17 2wn8 s ARG 364 CO 0.16 -0.95 -0.02 0.42 -0.81 0.00 0.00 175.30 174.09 2wn8 s ILE 365 N 1.99 3.57 -0.26 4.11 1.01 0.04 -1.20 121.20 130.47 2wn8 s ILE 365 Ca 0.09 -0.43 -0.21 0.00 0.00 0.00 0.00 60.65 60.10 2wn8 s ILE 365 Cb -0.20 -2.63 -0.02 0.00 0.01 0.00 0.00 42.46 39.63 2wn8 s ILE 365 CO 0.11 0.42 0.66 -0.89 0.00 0.00 0.00 174.94 175.23 2wn8 s THR 366 N 1.39 4.96 -0.28 2.92 2.01 -0.55 -0.37 115.64 125.71 2wn8 s THR 366 Ca 0.05 1.18 -0.11 0.00 0.31 0.00 0.00 61.69 63.12 2wn8 s THR 366 Cb -0.14 -3.97 -0.05 0.00 0.01 0.00 0.00 72.50 68.35 2wn8 s THR 366 CO -0.01 0.00 0.20 -0.63 -0.69 0.00 0.00 174.62 173.49 2wn8 s ILE 367 N 2.56 5.30 0.37 1.82 1.01 0.26 -1.77 121.20 130.76 2wn8 s ILE 367 Ca 0.27 0.20 -0.26 0.00 0.00 0.00 0.00 60.65 60.87 2wn8 s ILE 367 Cb -0.15 -3.54 -0.09 0.00 0.01 0.00 0.00 42.46 38.69 2wn8 s ILE 367 CO 0.08 0.25 1.09 -2.84 0.00 0.00 0.00 174.94 173.52 2wn8 s PRO 368 N 1.74 4.25 0.17 2.79 0.02 -1.26 -0.94 135.00 141.77 2wn8 s PRO 368 Ca 0.08 1.65 -0.33 0.00 0.02 0.00 0.00 61.00 62.41 2wn8 s PRO 368 Cb -0.16 -2.73 -0.16 0.00 0.02 0.00 0.00 34.50 31.48 2wn8 s PRO 368 CO 0.11 -0.09 1.22 0.36 -0.33 0.00 0.00 177.00 178.26 2wn8 n LYS 369 N 0.26 1.27 0.00 5.54 2.85 -1.26 -2.09 118.16 124.74 2wn8 n LYS 369 Ca 0.03 0.45 0.00 0.00 -1.05 0.00 0.00 58.31 57.75 2wn8 n LYS 369 Cb 0.48 -1.99 0.00 0.00 -0.65 0.00 0.00 35.03 32.87 2wn8 n LYS 369 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2wn8 n GLY 370 N 2.11 0.52 3.77 2.58 0.00 0.12 -4.96 105.19 109.34 2wn8 n GLY 370 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 2wn8 n GLY 370 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wn8 s SER 371 N -1.90 6.18 0.55 1.61 0.01 -0.89 -4.71 113.70 114.55 2wn8 s SER 371 Ca 0.00 2.31 -0.21 0.00 1.31 0.00 0.00 55.95 59.36 2wn8 s SER 371 Cb 0.00 -2.60 -0.05 0.00 0.21 0.00 0.00 66.02 63.58 2wn8 s SER 371 CO 0.00 -0.91 1.32 -2.84 0.41 0.00 0.00 173.24 171.22 2wn8 s PRO 372 N -2.68 3.15 0.00 12.44 0.02 -1.26 -1.14 135.00 145.52 2wn8 s PRO 372 Ca 0.63 2.15 0.00 0.00 0.02 0.00 0.00 61.00 63.80 2wn8 s PRO 372 Cb -0.29 -2.22 0.00 0.00 0.02 0.00 0.00 34.50 32.01 2wn8 s PRO 372 CO 0.35 -1.16 0.00 0.41 -0.33 0.00 0.00 177.00 176.27 2wn8 n GLY 373 N 0.70 2.90 3.51 0.52 0.00 -0.05 -4.51 105.19 108.26 2wn8 n GLY 373 Ca 0.11 -0.79 -0.14 0.00 0.00 0.00 0.00 46.02 45.20 2wn8 n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wn8 s ALA 374 N -2.00 -1.53 -0.77 4.61 0.00 -1.13 -4.35 121.76 116.59 2wn8 s ALA 374 Ca 0.00 1.62 -0.25 0.00 0.00 0.00 0.00 51.96 53.34 2wn8 s ALA 374 Cb 0.00 -0.82 0.05 0.00 0.00 0.00 0.00 23.12 22.35 2wn8 s ALA 374 CO 0.00 -0.30 1.21 -0.47 0.00 0.00 0.00 175.76 176.19 2wn8 s TYR 375 N 0.03 2.49 0.38 0.00 5.04 -1.26 -1.30 117.35 122.73 2wn8 s TYR 375 Ca -0.02 -0.41 0.11 0.00 -2.44 0.00 0.00 57.07 54.32 2wn8 s TYR 375 Cb -0.04 -4.52 0.75 0.00 0.35 0.00 0.00 41.96 38.50 2wn8 s TYR 375 CO 0.02 -1.90 1.86 -0.07 -1.34 0.00 0.00 175.55 174.13 2wn8 h LEU 376 N 12.34 0.09 0.00 6.97 3.38 -1.54 -2.59 115.31 133.96 2wn8 h LEU 376 Ca -0.18 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2wn8 h LEU 376 Cb 1.05 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2wn8 h LEU 376 CO 1.26 0.37 0.00 -1.20 0.09 0.00 0.00 178.44 178.97 2wn8 n SER 377 N -4.18 0.00 0.16 -0.43 7.64 -1.24 -1.35 113.62 114.23 2wn8 n SER 377 Ca -0.02 -1.08 0.05 0.00 1.01 0.00 0.00 58.87 58.84 2wn8 n SER 377 Cb 0.35 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 63.63 2wn8 n SER 377 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wn8 h ALA 378 N 2.27 0.77 -2.41 -0.43 0.00 -1.78 -3.43 119.26 114.25 2wn8 h ALA 378 Ca 0.00 -0.33 -0.60 0.00 0.00 0.00 0.00 54.91 53.98 2wn8 h ALA 378 Cb 0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 17.64 2wn8 h ALA 378 CO 0.00 0.46 0.30 0.42 0.00 0.00 0.00 179.25 180.43 2wn8 s ILE 379 N -3.06 4.92 0.02 0.00 1.01 -0.45 -4.84 121.20 118.80 2wn8 s ILE 379 Ca 0.04 1.37 -0.03 0.00 0.00 0.00 0.00 60.65 62.04 2wn8 s ILE 379 Cb 0.07 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.50 2wn8 s ILE 379 CO 0.72 0.00 0.19 -2.65 0.00 0.00 0.00 174.94 173.20 2wn8 n PRO 380 N 5.65 -0.04 0.00 2.79 -0.02 -1.26 -5.06 135.00 137.06 2wn8 n PRO 380 Ca 0.02 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2wn8 n PRO 380 Cb 0.48 -0.28 0.00 0.00 -0.02 0.00 0.00 33.50 33.69 2wn8 n PRO 380 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wn8 n GLY 381 N -1.02 2.54 2.90 -1.23 0.00 -1.26 -5.09 105.19 102.02 2wn8 n GLY 381 Ca 0.00 0.33 -0.16 0.00 0.00 0.00 0.00 46.02 46.18 2wn8 n GLY 381 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wn8 s GLU 385 N 0.00 0.41 -1.49 1.61 -1.05 -1.26 -5.13 118.70 111.79 2wn8 s GLU 385 Ca 0.00 -0.09 0.00 0.00 -0.15 0.00 0.00 54.97 54.73 2wn8 s GLU 385 Cb 0.00 -0.45 0.00 0.00 -0.44 0.00 0.00 34.13 33.24 2wn8 s GLU 385 CO 0.00 0.01 0.00 0.66 0.95 0.00 0.00 175.26 176.88 2wn8 n TYR 386 N 3.44 -0.42 -2.92 4.83 4.01 -1.26 -4.92 117.16 119.92 2wn8 n TYR 386 Ca -0.19 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.15 2wn8 n TYR 386 Cb 0.55 -3.02 -0.04 0.00 -0.31 0.00 0.00 39.34 36.52 2wn8 n TYR 386 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2wn8 s GLU 387 N -4.14 4.46 -0.16 -0.72 2.12 -1.26 -1.23 118.70 117.77 2wn8 s GLU 387 Ca 0.00 1.07 -0.03 0.00 0.36 0.00 0.00 54.97 56.37 2wn8 s GLU 387 Cb 0.00 -3.46 -0.02 0.00 0.26 0.00 0.00 34.13 30.90 2wn8 s GLU 387 CO 0.00 -0.01 -0.06 0.08 -0.54 0.00 0.00 175.26 174.72 2wn8 s VAL 388 N 1.01 3.56 -0.18 3.70 1.01 0.32 -1.21 120.40 128.60 2wn8 s VAL 388 Ca 0.42 -0.47 -0.08 0.00 0.00 0.00 0.00 61.98 61.85 2wn8 s VAL 388 Cb -0.19 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 2wn8 s VAL 388 CO 0.21 0.49 0.08 -0.22 0.00 0.00 0.00 175.10 175.65 2wn8 s LEU 389 N 0.56 3.90 0.08 3.92 2.96 -0.42 -0.30 118.68 129.39 2wn8 s LEU 389 Ca -0.04 0.12 0.05 0.00 -0.22 0.00 0.00 54.13 54.03 2wn8 s LEU 389 Cb -0.15 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.51 2wn8 s LEU 389 CO 0.03 0.18 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.46 2wn8 s LEU 390 N 0.33 3.38 0.38 -0.68 1.43 -0.15 -2.83 118.68 120.55 2wn8 s LEU 390 Ca 0.04 -0.20 -0.27 0.00 -1.03 0.00 0.00 54.13 52.67 2wn8 s LEU 390 Cb -0.12 -2.10 -0.10 0.00 0.03 0.00 0.00 46.19 43.90 2wn8 s LEU 390 CO -0.00 0.19 1.35 0.21 0.23 0.00 0.00 176.35 178.32 2wn8 s ASN 391 N -2.20 6.42 0.46 2.29 2.47 -1.26 -1.70 114.94 121.42 2wn8 s ASN 391 Ca 0.24 2.76 -0.25 0.00 0.42 0.00 0.00 52.86 56.03 2wn8 s ASN 391 Cb -0.12 -2.65 -0.08 0.00 -1.45 0.00 0.00 41.25 36.95 2wn8 s ASN 391 CO 0.16 -0.79 1.35 0.00 -3.72 0.00 0.00 177.10 174.11 2wn8 n HIS 392 N 0.36 2.38 -0.83 0.43 1.44 -1.26 -2.57 115.22 115.17 2wn8 n HIS 392 Ca 0.02 0.46 0.00 0.00 -2.01 0.00 0.00 57.72 56.19 2wn8 n HIS 392 Cb 0.42 -2.41 0.00 0.00 0.12 0.00 0.00 29.99 28.13 2wn8 n HIS 392 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2wn8 n GLY 393 N 0.71 0.64 3.76 -1.39 0.00 0.54 -4.96 105.19 104.49 2wn8 n GLY 393 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 2wn8 n GLY 393 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wn8 s SER 394 N -2.17 5.85 -0.07 1.61 0.01 -1.06 -4.71 113.70 113.16 2wn8 s SER 394 Ca 0.00 2.52 0.03 0.00 1.31 0.00 0.00 55.95 59.81 2wn8 s SER 394 Cb 0.00 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 63.59 2wn8 s SER 394 CO 0.00 -1.15 -0.17 -0.75 0.41 0.00 0.00 173.24 171.58 2wn8 s LYS 395 N -2.72 2.73 -0.02 12.44 2.20 -1.26 -1.20 119.74 131.92 2wn8 s LYS 395 Ca 0.66 -0.75 0.07 0.00 -0.36 0.00 0.00 55.97 55.59 2wn8 s LYS 395 Cb -0.34 -2.39 -0.02 0.00 -1.51 0.00 0.00 37.83 33.57 2wn8 s LYS 395 CO 0.41 0.46 -0.24 -0.06 -0.36 0.00 0.00 175.35 175.56 2wn8 s PHE 396 N -0.31 2.40 -0.31 4.03 0.08 0.56 -1.74 117.98 122.69 2wn8 s PHE 396 Ca 0.02 -0.38 -0.12 0.00 0.12 0.00 0.00 56.93 56.56 2wn8 s PHE 396 Cb -0.13 -1.52 -0.03 0.00 -0.57 0.00 0.00 43.02 40.77 2wn8 s PHE 396 CO 0.03 0.01 0.23 0.21 -0.10 0.00 0.00 175.22 175.60 2wn8 s LYS 397 N -0.67 3.72 -0.47 0.44 2.20 0.38 -0.01 119.74 125.34 2wn8 s LYS 397 Ca 0.10 -0.46 -0.26 0.00 -0.36 0.00 0.00 55.97 55.00 2wn8 s LYS 397 Cb -0.10 -3.74 0.03 0.00 -1.51 0.00 0.00 37.83 32.51 2wn8 s LYS 397 CO -0.01 -0.32 0.95 0.42 -0.36 0.00 0.00 175.35 176.03 2wn8 s ILE 398 N 1.77 4.44 -0.06 5.43 1.01 -0.51 -0.50 121.20 132.78 2wn8 s ILE 398 Ca 0.07 0.76 -0.17 0.00 0.00 0.00 0.00 60.65 61.31 2wn8 s ILE 398 Cb -0.17 -4.46 -0.31 0.00 0.01 0.00 0.00 42.46 37.54 2wn8 s ILE 398 CO 0.11 -0.88 0.76 0.78 0.00 0.00 0.00 174.94 175.71 2wn8 h ASN 399 N 9.12 0.52 -4.06 3.58 4.21 -0.93 0.12 115.58 128.13 2wn8 h ASN 399 Ca -0.24 -0.91 -0.04 0.00 1.21 0.00 0.00 56.30 56.32 2wn8 h ASN 399 Cb 1.07 -0.17 -0.21 0.00 -1.12 0.00 0.00 38.32 37.90 2wn8 h ASN 399 CO 1.04 1.57 0.14 -0.75 -1.29 0.00 0.00 177.43 178.15 2wn8 s LYS 400 N -2.49 0.85 -0.07 0.81 2.47 -1.04 -4.47 119.74 115.80 2wn8 s LYS 400 Ca -0.15 0.94 0.04 0.00 -1.56 0.00 0.00 55.97 55.23 2wn8 s LYS 400 Cb 0.03 0.41 0.00 0.00 -1.46 0.00 0.00 37.83 36.82 2wn8 s LYS 400 CO 0.83 -0.12 -0.20 0.42 0.16 0.00 0.00 175.35 176.44 2wn8 s ILE 401 N 0.25 1.74 0.12 5.43 1.01 -1.26 -0.04 121.20 128.45 2wn8 s ILE 401 Ca -0.01 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 59.82 2wn8 s ILE 401 Cb -0.05 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.87 2wn8 s ILE 401 CO 0.02 0.49 -0.09 -0.62 0.00 0.00 0.00 174.94 174.74 2wn8 s ASP 402 N 0.27 1.52 0.15 3.58 -1.08 -0.28 -4.97 116.67 115.85 2wn8 s ASP 402 Ca -0.13 -0.99 0.09 0.00 -0.52 0.00 0.00 52.55 51.00 2wn8 s ASP 402 Cb -0.16 0.03 -0.04 0.00 -1.46 0.00 0.00 42.92 41.29 2wn8 s ASP 402 CO 0.06 -0.37 -0.14 -0.94 0.52 0.00 0.00 175.17 174.30 2wn8 s SER 403 N -3.05 4.09 0.07 -0.34 1.04 -1.26 0.12 113.70 114.36 2wn8 s SER 403 Ca 0.14 -0.57 -0.04 0.00 0.48 0.00 0.00 55.95 55.96 2wn8 s SER 403 Cb 0.03 -0.64 -0.02 0.00 0.10 0.00 0.00 66.02 65.48 2wn8 s SER 403 CO -0.01 0.14 0.07 -0.72 0.98 0.00 0.00 173.24 173.70 2wn8 s TYR 404 N -1.44 0.36 -0.26 5.02 -0.85 -0.08 -4.93 117.35 115.16 2wn8 s TYR 404 Ca 0.22 -0.85 -0.14 0.00 -0.52 0.00 0.00 57.07 55.77 2wn8 s TYR 404 Cb -0.10 -0.24 -0.04 0.00 0.38 0.00 0.00 41.96 41.96 2wn8 s TYR 404 CO 0.13 -0.46 0.35 0.15 -1.52 0.00 0.00 175.55 174.20 2wn8 s LYS 405 N -3.89 4.04 -0.61 -3.49 -0.14 -1.26 -1.32 119.74 113.06 2wn8 s LYS 405 Ca 0.06 0.01 -0.05 0.00 -1.36 0.00 0.00 55.97 54.64 2wn8 s LYS 405 Cb 0.07 -3.63 0.16 0.00 -1.68 0.00 0.00 37.83 32.75 2wn8 s LYS 405 CO -0.10 -0.20 0.45 0.34 -0.76 0.00 0.00 175.35 175.07 2wn8 s ASP 406 N 1.51 5.46 1.61 2.83 -1.08 -0.08 -4.94 116.67 121.99 2wn8 s ASP 406 Ca 0.14 -2.67 0.00 0.00 -0.52 0.00 0.00 52.55 49.51 2wn8 s ASP 406 Cb -0.15 -1.91 0.00 0.00 -1.46 0.00 0.00 42.92 39.40 2wn8 s ASP 406 CO 0.09 -0.44 0.00 0.61 0.52 0.00 0.00 175.17 175.95 2wn8 n GLY 407 N 3.78 2.59 0.43 2.66 0.00 -1.26 -2.19 105.19 111.21 2wn8 n GLY 407 Ca 0.06 0.02 0.04 0.00 0.00 0.00 0.00 46.02 46.15 2wn8 n GLY 407 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wn8 n THR 408 N 0.00 0.60 -3.28 2.61 -2.24 -1.26 -4.93 114.28 105.78 2wn8 n THR 408 Ca 0.00 -0.80 -0.40 0.00 -2.27 0.00 0.00 64.05 60.58 2wn8 n THR 408 Cb 0.00 0.77 -0.08 0.00 -2.10 0.00 0.00 70.33 68.92 2wn8 n THR 408 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2wn8 s ILE 409 N -0.88 5.10 -0.01 2.28 -1.09 -0.93 -4.97 121.20 120.70 2wn8 s ILE 409 Ca 0.15 0.80 -0.30 0.00 -2.23 0.00 0.00 60.65 59.07 2wn8 s ILE 409 Cb 0.08 -3.79 -0.03 0.00 -1.58 0.00 0.00 42.46 37.14 2wn8 s ILE 409 CO 0.11 0.11 1.03 -0.89 -1.23 0.00 0.00 174.94 174.08 2wn8 s THR 410 N 2.21 4.68 0.27 2.92 2.01 -1.26 -0.91 115.64 125.57 2wn8 s THR 410 Ca 0.20 1.93 0.11 0.00 0.31 0.00 0.00 61.69 64.24 2wn8 s THR 410 Cb -0.16 -4.24 -0.05 0.00 0.01 0.00 0.00 72.50 68.06 2wn8 s THR 410 CO 0.09 0.12 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.42 2wn8 s LYS 411 N 1.25 1.61 0.00 4.92 1.02 -0.43 -4.50 119.74 123.61 2wn8 s LYS 411 Ca 0.53 -1.74 0.01 0.00 0.02 0.00 0.00 55.97 54.79 2wn8 s LYS 411 Cb -0.22 -1.62 -0.04 0.00 -0.52 0.00 0.00 37.83 35.43 2wn8 s LYS 411 CO 0.26 0.29 0.04 -0.51 -0.92 0.00 0.00 175.35 174.51 2wn8 s LEU 412 N -3.47 3.71 -0.26 3.17 1.43 0.07 -0.91 118.68 122.43 2wn8 s LEU 412 Ca 0.28 0.06 -0.04 0.00 -1.03 0.00 0.00 54.13 53.41 2wn8 s LEU 412 Cb -0.04 -2.16 0.01 0.00 0.03 0.00 0.00 46.19 44.04 2wn8 s LEU 412 CO 0.13 0.27 0.00 -0.63 0.23 0.00 0.00 176.35 176.36 2wn8 s ILE 413 N -1.15 3.46 -0.39 -0.59 1.01 0.32 -0.23 121.20 123.62 2wn8 s ILE 413 Ca 0.21 -0.74 -0.13 0.00 0.00 0.00 0.00 60.65 60.00 2wn8 s ILE 413 Cb -0.12 -2.72 0.03 0.00 0.01 0.00 0.00 42.46 39.66 2wn8 s ILE 413 CO 0.12 0.21 0.25 -0.69 0.00 0.00 0.00 174.94 174.84 2wn8 s VAL 414 N 1.44 4.86 -0.51 2.92 1.01 0.13 -1.13 120.40 129.13 2wn8 s VAL 414 Ca 0.03 -0.81 -0.22 0.00 0.00 0.00 0.00 61.98 60.98 2wn8 s VAL 414 Cb -0.16 -3.73 0.04 0.00 0.00 0.00 0.00 36.38 32.53 2wn8 s VAL 414 CO -0.01 -0.29 0.76 -0.62 0.00 0.00 0.00 175.10 174.94 2wn8 s ASP 415 N 1.65 6.30 0.10 3.32 2.15 0.94 -0.06 116.67 131.06 2wn8 s ASP 415 Ca 0.03 -0.56 0.06 0.00 0.43 0.00 0.00 52.55 52.52 2wn8 s ASP 415 Cb -0.19 -2.36 -0.03 0.00 -0.30 0.00 0.00 42.92 40.03 2wn8 s ASP 415 CO 0.08 -1.01 -0.16 0.00 -0.17 0.00 0.00 175.17 173.91 2wn8 s ALA 416 N 3.22 1.49 -0.06 3.66 0.00 -0.34 -0.23 121.76 129.49 2wn8 s ALA 416 Ca 0.23 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 51.04 2wn8 s ALA 416 Cb -0.15 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 2wn8 s ALA 416 CO 0.17 0.19 -0.19 0.95 0.00 0.00 0.00 175.76 176.88 2wn8 s THR 417 N -1.61 2.61 -0.09 0.00 -4.23 0.34 -1.48 115.64 111.18 2wn8 s THR 417 Ca 0.05 -0.87 -0.30 0.00 -1.18 0.00 0.00 61.69 59.39 2wn8 s THR 417 Cb -0.08 -2.00 -0.02 0.00 1.34 0.00 0.00 72.50 71.74 2wn8 s THR 417 CO 0.03 0.57 1.13 -0.22 -0.54 0.00 0.00 174.62 175.60 2wn8 s LEU 418 N -0.38 4.25 -0.16 4.79 2.96 -0.73 -0.47 118.68 128.94 2wn8 s LEU 418 Ca 0.03 1.69 -0.28 0.00 -0.22 0.00 0.00 54.13 55.35 2wn8 s LEU 418 Cb -0.12 -3.55 -0.01 0.00 0.50 0.00 0.00 46.19 43.01 2wn8 s LEU 418 CO 0.02 -0.56 0.95 -0.63 -1.32 0.00 0.00 176.35 174.81 2wn8 s ILE 419 N 2.31 4.79 -1.77 6.68 1.01 -0.71 -4.52 121.20 128.99 2wn8 s ILE 419 Ca 0.53 1.90 0.00 0.00 0.00 0.00 0.00 60.65 63.07 2wn8 s ILE 419 Cb -0.22 -4.25 0.00 0.00 0.01 0.00 0.00 42.46 38.00 2wn8 s ILE 419 CO 0.19 -0.04 0.44 -2.65 0.00 0.00 0.00 174.94 172.89