#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3itv h ARG 5 N 0.00 1.06 -5.24 -1.08 2.47 -1.93 -3.39 114.38 106.27 3itv h ARG 5 Ca 0.00 -0.09 -0.64 0.00 -1.26 0.00 0.00 59.98 57.99 3itv h ARG 5 Cb 0.00 -0.22 -0.22 0.00 -1.65 0.00 0.00 29.97 27.88 3itv h ARG 5 CO 0.00 0.74 -0.66 0.42 0.56 0.00 0.00 179.97 181.03 3itv s ILE 6 N -5.79 3.95 0.20 2.04 -1.09 -1.26 -5.04 121.20 114.20 3itv s ILE 6 Ca -0.11 -0.33 -0.33 0.00 -2.23 0.00 0.00 60.65 57.65 3itv s ILE 6 Cb 0.17 -2.75 -0.14 0.00 -1.58 0.00 0.00 42.46 38.16 3itv s ILE 6 CO 0.80 0.47 1.41 0.00 -1.23 0.00 0.00 174.94 176.39 3itv n ALA 7 N 3.76 0.75 -0.00 9.38 0.00 -1.26 -4.87 120.51 128.27 3itv n ALA 7 Ca -0.17 0.44 0.03 0.00 0.00 0.00 0.00 53.44 53.74 3itv n ALA 7 Cb 0.52 -2.24 0.40 0.00 0.00 0.00 0.00 19.45 18.13 3itv n ALA 7 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3itv h GLN 8 N 4.57 0.54 0.00 0.00 4.20 -1.97 -1.80 115.11 120.65 3itv h GLN 8 Ca -0.45 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.16 3itv h GLN 8 Cb 1.28 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.94 3itv h GLN 8 CO 0.78 0.39 -0.29 0.38 -0.67 0.00 0.00 178.83 179.42 3itv h ASP 9 N 0.55 0.00 -0.11 1.46 -0.00 -1.99 -0.33 116.42 116.01 3itv h ASP 9 Ca 0.15 0.00 -0.14 0.00 -0.00 0.00 0.00 57.03 57.04 3itv h ASP 9 Cb -0.01 0.00 0.01 0.00 -0.00 0.00 0.00 39.33 39.33 3itv h ASP 9 CO -0.03 0.29 -0.47 0.58 -0.00 0.00 0.00 179.24 179.61 3itv h VAL 10 N 0.00 1.37 -0.39 4.15 2.07 -1.70 -0.37 116.25 121.37 3itv h VAL 10 Ca -0.00 -1.79 -0.00 0.00 0.82 0.00 0.00 66.70 65.72 3itv h VAL 10 Cb 0.61 2.18 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 3itv h VAL 10 CO 0.04 0.54 0.24 0.58 0.02 0.00 0.00 177.57 178.99 3itv h VAL 11 N 0.10 1.12 -0.24 2.57 2.07 -1.12 -0.72 116.25 120.03 3itv h VAL 11 Ca -0.03 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 3itv h VAL 11 Cb 1.11 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 3itv h VAL 11 CO 0.10 0.12 0.11 0.00 0.02 0.00 0.00 177.57 177.92 3itv h ALA 12 N 1.11 0.31 -0.46 1.67 0.00 -1.05 -1.66 119.26 119.19 3itv h ALA 12 Ca 0.14 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.97 3itv h ALA 12 Cb -0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3itv h ALA 12 CO -0.03 -0.11 0.28 -0.09 0.00 0.00 0.00 179.25 179.30 3itv h ARG 13 N 0.25 0.55 0.00 0.00 2.43 -0.82 -0.35 114.38 116.43 3itv h ARG 13 Ca 0.08 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 3itv h ARG 13 Cb 0.14 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 3itv h ARG 13 CO -0.01 0.36 -0.14 0.93 -1.51 0.00 0.00 179.97 179.61 3itv h GLU 14 N 0.56 0.00 0.11 0.20 4.39 -1.06 -2.29 114.58 116.51 3itv h GLU 14 Ca 0.18 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.72 3itv h GLU 14 Cb -0.01 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.66 3itv h GLU 14 CO -0.07 0.14 -0.69 -0.91 -1.16 0.00 0.00 179.01 176.31 3itv h ASN 15 N 0.00 0.38 -0.62 1.42 2.35 -0.84 -3.26 115.58 115.01 3itv h ASN 15 Ca -0.00 -0.96 0.04 0.00 -0.55 0.00 0.00 56.30 54.83 3itv h ASN 15 Cb 0.72 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.93 3itv h ASN 15 CO 0.02 1.33 0.41 0.44 -1.65 0.00 0.00 177.43 177.98 3itv h ASP 16 N -0.49 0.62 0.36 5.81 3.32 -1.00 0.12 116.42 125.16 3itv h ASP 16 Ca -0.12 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 56.89 3itv h ASP 16 Cb 1.53 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.93 3itv h ASP 16 CO 0.12 0.42 -0.13 -0.09 -1.72 0.00 0.00 179.24 177.84 3itv h ARG 17 N 0.72 0.00 -0.05 3.56 2.43 -1.49 -3.02 114.38 116.53 3itv h ARG 17 Ca 0.25 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 3itv h ARG 17 Cb 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 3itv h ARG 17 CO -0.07 0.13 0.00 0.54 -1.51 0.00 0.00 179.97 179.07 3itv n ARG 18 N -3.72 0.53 -0.22 0.20 1.74 -0.39 -4.75 116.66 110.05 3itv n ARG 18 Ca -0.02 -1.09 -0.06 0.00 -0.77 0.00 0.00 57.85 55.92 3itv n ARG 18 Cb 0.25 -1.13 0.04 0.00 -1.02 0.00 0.00 32.46 30.59 3itv n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3itv h ALA 19 N 1.28 0.79 0.02 7.54 0.00 -0.69 -2.33 119.26 125.87 3itv h ALA 19 Ca 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3itv h ALA 19 Cb 0.35 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3itv h ALA 19 CO 0.00 0.21 -0.01 1.03 0.00 0.00 0.00 179.25 180.48 3itv h SER 20 N 0.83 -0.02 -0.62 0.00 0.87 -1.85 -0.28 113.55 112.48 3itv h SER 20 Ca 0.23 -0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.72 3itv h SER 20 Cb -0.08 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.85 3itv h SER 20 CO -0.05 0.01 0.22 0.00 -0.53 0.00 0.00 176.83 176.48 3itv h ALA 21 N 0.93 1.17 -0.54 6.23 0.00 -1.89 -1.80 119.26 123.35 3itv h ALA 21 Ca -0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3itv h ALA 21 Cb 0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3itv h ALA 21 CO 0.00 0.59 0.20 1.25 0.00 0.00 0.00 179.25 181.29 3itv h LEU 22 N 0.95 0.76 -0.58 0.00 5.85 -1.18 -0.86 115.31 120.25 3itv h LEU 22 Ca 0.21 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.78 3itv h LEU 22 Cb 0.24 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 3itv h LEU 22 CO -0.01 0.74 0.36 0.50 -0.34 0.00 0.00 178.44 179.68 3itv h LYS 23 N 0.74 0.69 -0.36 1.25 3.64 -0.59 0.33 116.57 122.27 3itv h LYS 23 Ca 0.18 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 3itv h LYS 23 Cb 0.22 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 3itv h LYS 23 CO -0.01 0.45 0.14 0.93 -2.27 0.00 0.00 179.45 178.69 3itv h GLU 24 N 0.71 0.54 -0.43 1.90 4.39 -1.00 -1.04 114.58 119.64 3itv h GLU 24 Ca 0.23 -0.10 -0.12 0.00 0.34 0.00 0.00 59.36 59.72 3itv h GLU 24 Cb 0.02 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 3itv h GLU 24 CO -0.10 0.53 -0.19 -0.44 -1.16 0.00 0.00 179.01 177.65 3itv h ASP 25 N 0.43 0.91 -0.51 1.42 3.32 -0.76 -1.71 116.42 119.51 3itv h ASP 25 Ca 0.12 -0.40 -0.10 0.00 0.02 0.00 0.00 57.03 56.67 3itv h ASP 25 Cb 0.19 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 3itv h ASP 25 CO -0.01 1.11 -0.06 0.22 -1.72 0.00 0.00 179.24 178.78 3itv h TYR 26 N 0.72 1.05 -0.32 4.55 5.03 -0.29 -0.68 116.97 127.03 3itv h TYR 26 Ca 0.10 -0.20 -0.12 0.00 2.58 0.00 0.00 58.73 61.08 3itv h TYR 26 Cb 0.75 -0.27 -0.01 0.00 1.55 0.00 0.00 36.73 38.76 3itv h TYR 26 CO 0.06 0.99 -0.29 0.93 -1.32 0.00 0.00 178.16 178.52 3itv h GLU 27 N 0.81 0.67 -0.29 1.82 5.08 -1.16 0.46 114.58 121.98 3itv h GLU 27 Ca 0.14 -0.29 -0.07 0.00 -1.00 0.00 0.00 59.36 58.14 3itv h GLU 27 Cb 0.61 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3itv h GLU 27 CO 0.04 0.89 -0.08 0.00 -1.00 0.00 0.00 179.01 178.85 3itv h ALA 28 N 1.10 0.40 -0.59 3.43 0.00 -1.15 -1.47 119.26 120.97 3itv h ALA 28 Ca 0.07 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 3itv h ALA 28 Cb 0.79 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 3itv h ALA 28 CO 0.06 0.23 0.12 1.25 0.00 0.00 0.00 179.25 180.91 3itv h LEU 29 N 0.32 0.89 -0.73 0.00 5.85 -1.00 -1.01 115.31 119.63 3itv h LEU 29 Ca 0.07 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.61 3itv h LEU 29 Cb 0.57 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 3itv h LEU 29 CO 0.03 0.88 0.47 1.23 -0.34 0.00 0.00 178.44 180.71 3itv h GLY 30 N 1.02 1.04 1.07 3.75 0.00 -0.68 0.14 103.07 109.40 3itv h GLY 30 Ca 0.19 -0.40 -0.11 0.00 0.00 0.00 0.00 47.33 47.01 3itv h GLY 30 CO 0.00 0.39 -0.08 0.00 0.00 0.00 0.00 176.54 176.86 3itv h ALA 31 N 1.25 0.73 -0.32 3.60 0.00 -0.88 -0.86 119.26 122.79 3itv h ALA 31 Ca 0.26 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3itv h ALA 31 Cb -0.08 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3itv h ALA 31 CO -0.05 0.63 0.11 -0.97 0.00 0.00 0.00 179.25 178.96 3itv h ASN 32 N 0.88 0.45 -0.18 0.00 -0.73 -0.71 -2.08 115.58 113.21 3itv h ASN 32 Ca 0.14 -0.19 -0.06 0.00 1.87 0.00 0.00 56.30 58.06 3itv h ASN 32 Cb 0.64 -0.12 -0.02 0.00 0.27 0.00 0.00 38.32 39.10 3itv h ASN 32 CO 0.04 0.52 -0.08 -0.07 -0.37 0.00 0.00 177.43 177.47 3itv h LEU 33 N 0.36 0.50 -0.90 0.34 3.38 -0.63 -2.41 115.31 115.94 3itv h LEU 33 Ca 0.10 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 3itv h LEU 33 Cb 0.23 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 3itv h LEU 33 CO -0.01 0.62 0.29 0.00 0.09 0.00 0.00 178.44 179.43 3itv h ALA 34 N 1.43 1.13 0.00 1.53 0.00 -0.86 0.24 119.26 122.73 3itv h ALA 34 Ca 0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3itv h ALA 34 Cb 0.44 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3itv h ALA 34 CO 0.02 0.62 -0.07 0.00 0.00 0.00 0.00 179.25 179.83 3itv h ARG 35 N 1.06 0.00 -0.63 0.00 3.08 -0.89 -1.00 114.38 116.00 3itv h ARG 35 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 3itv h ARG 35 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 3itv h ARG 35 CO -0.02 0.07 0.00 0.54 -1.07 0.00 0.00 179.97 179.49 3itv n ARG 36 N -3.32 2.48 -1.76 0.04 1.74 -0.25 -4.94 116.66 110.66 3itv n ARG 36 Ca -0.01 -2.30 -0.09 0.00 -0.77 0.00 0.00 57.85 54.68 3itv n ARG 36 Cb 0.25 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.17 3itv n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3itv n GLY 37 N 1.52 0.50 3.30 -0.13 0.00 -0.38 -5.03 105.19 104.98 3itv n GLY 37 Ca 0.21 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 3itv n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3itv s VAL 38 N -2.41 2.34 -0.47 1.61 1.01 0.69 -4.98 120.40 118.19 3itv s VAL 38 Ca 0.00 -0.95 -0.21 0.00 0.00 0.00 0.00 61.98 60.82 3itv s VAL 38 Cb 0.00 -1.89 0.03 0.00 0.00 0.00 0.00 36.38 34.53 3itv s VAL 38 CO 0.00 0.56 0.67 -0.62 0.00 0.00 0.00 175.10 175.71 3itv s ASP 39 N -0.09 6.30 0.43 3.32 2.15 -1.26 -2.95 116.67 124.57 3itv s ASP 39 Ca -0.05 -0.48 0.16 0.00 0.43 0.00 0.00 52.55 52.61 3itv s ASP 39 Cb -0.14 -2.32 1.06 0.00 -0.30 0.00 0.00 42.92 41.22 3itv s ASP 39 CO 0.04 -0.85 1.91 -0.29 -0.17 0.00 0.00 175.17 175.81 3itv h ILE 40 N 5.89 0.78 -0.60 4.11 6.09 -1.93 -1.23 117.51 130.62 3itv h ILE 40 Ca -0.26 -0.14 -0.04 0.00 -1.37 0.00 0.00 64.86 63.05 3itv h ILE 40 Cb 1.09 0.33 -0.03 0.00 0.47 0.00 0.00 36.82 38.69 3itv h ILE 40 CO 0.93 0.07 0.23 -0.08 -3.07 0.00 0.00 178.15 176.23 3itv h GLU 41 N 0.41 0.88 -0.32 2.19 4.57 -1.99 -1.11 114.58 119.21 3itv h GLU 41 Ca 0.38 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 58.36 3itv h GLU 41 Cb 0.90 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.32 3itv h GLU 41 CO -0.12 0.73 -0.07 0.00 -1.18 0.00 0.00 179.01 178.37 3itv h ALA 42 N 1.38 1.28 -0.05 2.92 0.00 -1.64 -0.54 119.26 122.61 3itv h ALA 42 Ca 0.20 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3itv h ALA 42 Cb 0.19 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3itv h ALA 42 CO -0.02 0.48 -0.19 0.28 0.00 0.00 0.00 179.25 179.80 3itv h VAL 43 N 0.49 1.45 -0.86 0.00 2.07 -1.32 -3.00 116.25 115.07 3itv h VAL 43 Ca 0.10 -1.60 0.01 0.00 0.82 0.00 0.00 66.70 66.03 3itv h VAL 43 Cb 0.43 2.35 -0.04 0.00 -1.52 0.00 0.00 31.29 32.51 3itv h VAL 43 CO 0.02 0.45 0.57 0.74 0.02 0.00 0.00 177.57 179.37 3itv h THR 44 N -0.31 1.21 -0.88 2.57 2.02 -1.06 -0.28 112.91 116.18 3itv h THR 44 Ca -0.01 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.77 3itv h THR 44 Cb 0.82 -0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.15 3itv h THR 44 CO 0.04 0.21 0.53 0.00 0.37 0.00 0.00 175.52 176.67 3itv h ALA 45 N 1.47 1.29 0.00 6.16 0.00 -1.11 -0.89 119.26 126.18 3itv h ALA 45 Ca 0.32 -0.10 -0.27 0.00 0.00 0.00 0.00 54.91 54.86 3itv h ALA 45 Cb -0.11 -0.35 0.02 0.00 0.00 0.00 0.00 17.79 17.34 3itv h ALA 45 CO -0.07 0.62 -1.05 0.87 0.00 0.00 0.00 179.25 179.62 3itv h LYS 46 N 1.21 0.70 -0.82 0.00 1.57 -1.24 -3.25 116.57 114.74 3itv h LYS 46 Ca 0.31 -0.76 -0.00 0.00 -1.87 0.00 0.00 60.65 58.33 3itv h LYS 46 Cb -0.06 0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.43 3itv h LYS 46 CO -0.06 1.33 0.50 0.28 -0.57 0.00 0.00 179.45 180.93 3itv h VAL 47 N 0.39 1.22 0.00 0.50 2.07 -0.74 -1.76 116.25 117.94 3itv h VAL 47 Ca -0.13 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 3itv h VAL 47 Cb 1.70 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.53 3itv h VAL 47 CO 0.21 0.23 -0.03 -0.33 0.02 0.00 0.00 177.57 177.66 3itv h GLU 48 N 1.12 0.00 -0.29 1.57 5.08 -1.20 -2.34 114.58 118.52 3itv h GLU 48 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 3itv h GLU 48 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3itv h GLU 48 CO -0.06 0.03 0.00 1.63 -1.00 0.00 0.00 179.01 179.62 3itv n LYS 49 N -4.01 2.34 -3.04 2.33 5.02 -0.68 -4.91 118.16 115.21 3itv n LYS 49 Ca -0.03 -2.01 -0.41 0.00 -2.02 0.00 0.00 58.31 53.84 3itv n LYS 49 Cb 0.12 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.58 3itv n LYS 49 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 3itv s PHE 50 N -1.63 3.28 0.12 2.13 5.36 -0.88 -5.04 117.98 121.32 3itv s PHE 50 Ca 0.36 0.90 0.10 0.00 -0.96 0.00 0.00 56.93 57.33 3itv s PHE 50 Cb 0.21 -2.92 -0.04 0.00 -0.34 0.00 0.00 43.02 39.93 3itv s PHE 50 CO 0.31 -0.36 -0.25 -0.06 -1.46 0.00 0.00 175.22 173.39 3itv s PHE 51 N 2.62 2.17 -0.02 10.12 0.08 -1.26 -4.72 117.98 126.97 3itv s PHE 51 Ca 0.29 -0.39 -0.01 0.00 0.12 0.00 0.00 56.93 56.94 3itv s PHE 51 Cb -0.15 -1.18 0.02 0.00 -0.57 0.00 0.00 43.02 41.13 3itv s PHE 51 CO 0.08 0.30 0.04 0.54 -0.10 0.00 0.00 175.22 176.09 3itv s VAL 52 N -1.08 -0.03 0.41 -0.44 0.11 -0.36 -4.72 120.40 114.29 3itv s VAL 52 Ca 0.12 0.12 -0.23 0.00 -2.93 0.00 0.00 61.98 59.05 3itv s VAL 52 Cb -0.10 -0.09 -0.09 0.00 -1.53 0.00 0.00 36.38 34.58 3itv s VAL 52 CO 0.05 0.05 1.06 0.00 -3.33 0.00 0.00 175.10 172.93 3itv s ALA 53 N 0.63 3.05 -0.08 1.54 0.00 -0.29 -4.20 121.76 122.41 3itv s ALA 53 Ca -0.05 0.71 -0.03 0.00 0.00 0.00 0.00 51.96 52.59 3itv s ALA 53 Cb -0.07 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 3itv s ALA 53 CO -0.02 -0.26 0.06 0.14 0.00 0.00 0.00 175.76 175.68 3itv s VAL 54 N -1.68 4.74 -0.02 0.00 -7.23 -0.59 -0.75 120.40 114.87 3itv s VAL 54 Ca 0.59 -0.16 -0.29 0.00 -1.81 0.00 0.00 61.98 60.32 3itv s VAL 54 Cb -0.22 -3.06 -0.03 0.00 0.56 0.00 0.00 36.38 33.63 3itv s VAL 54 CO 0.27 0.55 0.92 -2.16 -0.31 0.00 0.00 175.10 174.37 3itv s PRO 55 N -1.13 4.52 0.42 4.82 0.04 -1.25 -0.68 135.00 141.74 3itv s PRO 55 Ca 0.16 1.30 0.09 0.00 0.04 0.00 0.00 61.00 62.59 3itv s PRO 55 Cb -0.12 -3.47 0.90 0.00 0.04 0.00 0.00 34.50 31.86 3itv s PRO 55 CO 0.06 -0.05 2.04 0.66 0.04 0.00 0.00 177.00 179.74 3itv h SER 56 N 6.82 0.34 0.00 6.66 4.64 -1.71 -0.39 113.55 129.92 3itv h SER 56 Ca -0.40 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3itv h SER 56 Cb 1.21 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3itv h SER 56 CO 0.76 0.30 0.00 -2.67 -0.87 0.00 0.00 176.83 174.35 3itv n TRP 57 N -4.44 0.00 0.68 4.77 2.14 -1.26 -3.30 117.44 116.03 3itv n TRP 57 Ca 0.01 0.00 0.11 0.00 2.07 0.00 0.00 57.50 59.69 3itv n TRP 57 Cb 0.11 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.57 3itv n TRP 57 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 3itv n GLY 58 N 0.84 -1.10 0.08 -1.67 0.00 -0.16 -4.23 105.19 98.95 3itv n GLY 58 Ca 0.20 -0.49 0.14 0.00 0.00 0.00 0.00 46.02 45.87 3itv n GLY 58 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3itv n VAL 59 N -1.80 0.00 -3.99 1.61 0.24 -1.21 -4.66 118.33 108.52 3itv n VAL 59 Ca 0.02 -0.04 -0.23 0.00 -2.04 0.00 0.00 64.34 62.05 3itv n VAL 59 Cb 0.41 -0.09 -0.03 0.00 -1.47 0.00 0.00 33.84 32.66 3itv n VAL 59 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3itv s GLY 60 N -2.68 1.42 0.28 7.63 0.00 -1.26 -4.65 107.32 108.05 3itv s GLY 60 Ca 0.22 -1.20 -0.29 0.00 0.00 0.00 0.00 44.72 43.45 3itv s GLY 60 CO 0.53 -1.21 1.23 -1.59 0.00 0.00 0.00 173.10 172.06 3itv s THR 61 N -1.91 3.14 0.69 0.90 2.01 -1.26 -4.61 115.64 114.60 3itv s THR 61 Ca 0.34 1.08 0.03 0.00 0.31 0.00 0.00 61.69 63.45 3itv s THR 61 Cb -0.10 -3.69 0.13 0.00 0.01 0.00 0.00 72.50 68.86 3itv s THR 61 CO 0.28 0.23 0.95 0.61 -0.69 0.00 0.00 174.62 176.00 3itv n GLY 62 N 1.36 1.10 3.34 4.40 0.00 -0.08 -4.93 105.19 110.37 3itv n GLY 62 Ca 0.01 -2.10 -0.12 0.00 0.00 0.00 0.00 46.02 43.81 3itv n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3itv n GLY 63 N -2.61 1.69 3.27 -0.02 0.00 -1.23 -4.36 105.19 101.92 3itv n GLY 63 Ca 0.17 -1.45 -0.29 0.00 0.00 0.00 0.00 46.02 44.45 3itv n GLY 63 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3itv n THR 64 N -0.53 0.00 0.52 2.61 -2.24 -0.60 -4.49 114.28 109.56 3itv n THR 64 Ca -0.03 -2.14 0.07 0.00 -2.27 0.00 0.00 64.05 59.68 3itv n THR 64 Cb 0.56 0.40 0.32 0.00 -2.10 0.00 0.00 70.33 69.51 3itv n THR 64 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3itv n ARG 65 N -1.17 0.02 -0.02 -0.78 1.85 -1.26 -2.03 116.66 113.26 3itv n ARG 65 Ca -0.18 0.24 -0.13 0.00 -1.00 0.00 0.00 57.85 56.78 3itv n ARG 65 Cb 0.58 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.34 3itv n ARG 65 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3itv n PHE 66 N -1.49 0.97 -3.61 2.89 3.72 -1.26 -3.29 117.46 115.39 3itv n PHE 66 Ca 0.04 0.29 -0.01 0.00 -0.05 0.00 0.00 57.45 57.71 3itv n PHE 66 Cb 0.17 -1.16 -0.01 0.00 -0.94 0.00 0.00 39.48 37.54 3itv n PHE 66 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3itv s ALA 67 N -2.57 -2.21 -0.06 4.37 0.00 -1.14 -4.12 121.76 116.02 3itv s ALA 67 Ca -0.12 1.48 0.01 0.00 0.00 0.00 0.00 51.96 53.32 3itv s ALA 67 Cb 0.07 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.12 3itv s ALA 67 CO 0.80 -0.72 -0.07 0.50 0.00 0.00 0.00 175.76 176.26 3itv s ARG 68 N -2.22 1.22 -0.74 0.00 3.52 -0.82 -1.55 118.95 118.36 3itv s ARG 68 Ca 0.12 -0.22 0.03 0.00 -0.13 0.00 0.00 55.73 55.53 3itv s ARG 68 Cb 0.01 -1.16 0.18 0.00 -1.56 0.00 0.00 34.95 32.42 3itv s ARG 68 CO -0.04 -0.09 0.55 -0.06 -0.81 0.00 0.00 175.30 174.86 3itv s PHE 69 N 1.02 3.64 0.70 5.12 0.40 -1.26 -2.72 117.98 124.88 3itv s PHE 69 Ca -0.09 -3.26 -0.16 0.00 -0.60 0.00 0.00 56.93 52.82 3itv s PHE 69 Cb -0.14 -2.85 0.02 0.00 0.51 0.00 0.00 43.02 40.56 3itv s PHE 69 CO -0.00 -0.60 1.26 -1.25 0.70 0.00 0.00 175.22 175.32 3itv s PRO 70 N -1.38 2.26 0.00 0.24 0.04 -1.26 -4.96 135.00 129.94 3itv s PRO 70 Ca 0.25 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.22 3itv s PRO 70 Cb -0.06 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.65 3itv s PRO 70 CO -0.15 -1.79 0.00 0.41 0.04 0.00 0.00 177.00 175.52 3itv n GLY 71 N 0.70 1.91 3.90 0.56 0.00 -1.26 -4.97 105.19 106.02 3itv n GLY 71 Ca 0.15 -2.06 -0.29 0.00 0.00 0.00 0.00 46.02 43.83 3itv n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3itv s THR 72 N 1.82 4.90 -1.50 2.61 -4.23 -1.26 -4.30 115.64 113.68 3itv s THR 72 Ca 0.00 0.29 -0.05 0.00 -1.18 0.00 0.00 61.69 60.75 3itv s THR 72 Cb 0.00 -3.78 0.01 0.00 1.34 0.00 0.00 72.50 70.07 3itv s THR 72 CO 0.00 -0.55 0.71 0.61 -0.54 0.00 0.00 174.62 174.84 3itv n GLY 73 N -1.48 -0.50 3.77 3.99 0.00 -1.26 -4.77 105.19 104.93 3itv n GLY 73 Ca 0.00 0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3itv n GLY 73 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3itv s GLU 74 N -5.79 3.91 0.31 1.61 0.41 -1.26 -4.75 118.70 113.13 3itv s GLU 74 Ca 0.35 2.26 -0.29 0.00 -0.41 0.00 0.00 54.97 56.88 3itv s GLU 74 Cb -0.15 -2.75 -0.11 0.00 -1.78 0.00 0.00 34.13 29.34 3itv s GLU 74 CO 0.43 -0.58 1.45 -2.14 -0.49 0.00 0.00 175.26 173.93 3itv s PRO 75 N -2.28 4.22 0.15 0.39 0.02 -1.26 -4.83 135.00 131.41 3itv s PRO 75 Ca 0.58 2.41 0.06 0.00 0.02 0.00 0.00 61.00 64.07 3itv s PRO 75 Cb -0.40 -3.05 -0.10 0.00 0.02 0.00 0.00 34.50 30.97 3itv s PRO 75 CO 0.52 -0.44 1.34 0.00 -0.33 0.00 0.00 177.00 178.09 3itv h ARG 76 N 4.08 0.04 0.00 5.54 3.08 -1.93 -3.48 114.38 121.70 3itv h ARG 76 Ca -0.48 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.52 3itv h ARG 76 Cb 1.23 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.29 3itv h ARG 76 CO 0.72 0.95 0.00 0.41 -1.07 0.00 0.00 179.97 180.97 3itv n GLY 77 N 1.13 1.61 0.28 0.04 0.00 -1.26 -5.02 105.19 101.96 3itv n GLY 77 Ca -0.01 -0.76 0.05 0.00 0.00 0.00 0.00 46.02 45.31 3itv n GLY 77 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3itv h ILE 78 N 0.36 1.08 -0.43 -0.61 6.09 -1.91 -1.62 117.51 120.46 3itv h ILE 78 Ca 0.00 -0.22 -0.14 0.00 -1.37 0.00 0.00 64.86 63.13 3itv h ILE 78 Cb 0.00 0.84 -0.01 0.00 0.47 0.00 0.00 36.82 38.12 3itv h ILE 78 CO 0.00 0.09 -0.27 -0.26 -3.07 0.00 0.00 178.15 174.63 3itv h PHE 79 N 0.26 1.08 -0.48 2.19 0.04 -1.97 0.01 116.94 118.07 3itv h PHE 79 Ca 0.07 -0.28 -0.13 0.00 2.80 0.00 0.00 57.97 60.42 3itv h PHE 79 Cb 0.05 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 3itv h PHE 79 CO 0.00 1.09 -0.22 -0.44 -0.60 0.00 0.00 178.31 178.14 3itv h ASP 80 N 0.79 1.02 -0.78 2.17 3.32 -1.87 -2.26 116.42 118.81 3itv h ASP 80 Ca 0.09 -0.39 -0.00 0.00 0.02 0.00 0.00 57.03 56.75 3itv h ASP 80 Cb 0.85 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 40.08 3itv h ASP 80 CO 0.07 1.19 0.47 0.11 -1.72 0.00 0.00 179.24 179.36 3itv h LYS 81 N 0.86 1.06 -0.65 3.56 1.57 -1.01 -0.80 116.57 121.16 3itv h LYS 81 Ca 0.11 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 3itv h LYS 81 Cb 0.80 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.86 3itv h LYS 81 CO 0.07 0.75 0.08 -0.07 -0.57 0.00 0.00 179.45 179.71 3itv h LEU 82 N 1.07 1.05 -0.92 2.94 3.38 -0.88 0.33 115.31 122.27 3itv h LEU 82 Ca 0.28 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 58.01 3itv h LEU 82 Cb -0.04 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.39 3itv h LEU 82 CO -0.05 1.05 0.61 0.44 0.09 0.00 0.00 178.44 180.58 3itv h ASP 83 N 1.01 1.04 -0.13 -0.43 3.32 -0.77 -0.64 116.42 119.81 3itv h ASP 83 Ca 0.19 -0.02 -0.18 0.00 0.02 0.00 0.00 57.03 57.05 3itv h ASP 83 Cb 0.47 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 3itv h ASP 83 CO 0.02 0.74 -0.57 0.44 -1.72 0.00 0.00 179.24 178.15 3itv h ASP 84 N 1.22 0.81 0.02 6.45 3.32 -0.72 -2.87 116.42 124.65 3itv h ASP 84 Ca 0.35 -0.44 -0.04 0.00 0.02 0.00 0.00 57.03 56.92 3itv h ASP 84 Cb -0.09 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.22 3itv h ASP 84 CO -0.09 1.20 -0.10 0.00 -1.72 0.00 0.00 179.24 178.54 3itv h ALA 86 N 1.73 1.72 -0.35 0.00 0.00 -0.90 -1.90 119.26 119.57 3itv h ALA 86 Ca 0.04 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 3itv h ALA 86 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3itv h ALA 86 CO 0.02 0.22 -0.04 0.28 0.00 0.00 0.00 179.25 179.73 3itv h VAL 87 N 0.28 1.27 -0.45 0.00 2.07 -1.29 -0.07 116.25 118.05 3itv h VAL 87 Ca 0.07 -1.06 0.03 0.00 0.82 0.00 0.00 66.70 66.55 3itv h VAL 87 Cb 0.11 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 3itv h VAL 87 CO -0.00 0.35 0.25 0.40 0.02 0.00 0.00 177.57 178.59 3itv h ILE 88 N 0.45 1.02 -0.32 4.57 1.08 -1.30 -1.63 117.51 121.37 3itv h ILE 88 Ca 0.09 -0.17 -0.08 0.00 -0.39 0.00 0.00 64.86 64.32 3itv h ILE 88 Cb 0.52 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 34.73 3itv h ILE 88 CO 0.03 0.09 -0.10 -0.61 -0.69 0.00 0.00 178.15 176.86 3itv h GLN 89 N 0.50 0.63 -0.77 2.37 5.75 -1.30 -0.57 115.11 121.73 3itv h GLN 89 Ca 0.18 -0.25 0.02 0.00 -0.15 0.00 0.00 58.65 58.45 3itv h GLN 89 Cb 0.04 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.52 3itv h GLN 89 CO -0.10 0.83 0.50 0.37 -2.65 0.00 0.00 178.83 177.77 3itv h GLN 90 N 0.40 0.96 0.14 1.69 4.15 -0.76 0.36 115.11 122.05 3itv h GLN 90 Ca 0.08 -0.06 -0.31 0.00 0.77 0.00 0.00 58.65 59.13 3itv h GLN 90 Cb 0.61 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 28.08 3itv h GLN 90 CO 0.04 0.64 -1.48 -0.07 -1.93 0.00 0.00 178.83 176.02 3itv h LEU 91 N 0.99 0.46 0.00 -2.39 3.38 -1.28 -3.34 115.31 113.13 3itv h LEU 91 Ca 0.30 -0.59 -0.21 0.00 0.09 0.00 0.00 57.88 57.46 3itv h LEU 91 Cb -0.05 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 3itv h LEU 91 CO -0.09 1.48 -2.07 0.35 0.09 0.00 0.00 178.44 178.20 3itv n THR 92 N -3.50 0.91 -1.49 0.22 -2.24 -0.23 -1.22 114.28 106.73 3itv n THR 92 Ca -0.15 -0.71 -0.17 0.00 -2.27 0.00 0.00 64.05 60.74 3itv n THR 92 Cb 1.05 -0.37 -0.07 0.00 -2.10 0.00 0.00 70.33 68.83 3itv n THR 92 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3itv n ARG 93 N -2.62 -1.53 -0.02 -0.78 5.12 0.13 -4.78 116.66 112.16 3itv n ARG 93 Ca -0.19 1.10 0.04 0.00 -1.93 0.00 0.00 57.85 56.86 3itv n ARG 93 Cb 0.91 -5.49 0.04 0.00 -1.16 0.00 0.00 32.46 26.76 3itv n ARG 93 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3itv n ALA 94 N 1.31 2.43 -3.09 7.54 0.00 -1.26 -4.77 120.51 122.67 3itv n ALA 94 Ca -0.17 -0.65 -0.22 0.00 0.00 0.00 0.00 53.44 52.40 3itv n ALA 94 Cb 0.65 -0.25 -0.04 0.00 0.00 0.00 0.00 19.45 19.81 3itv n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3itv n THR 95 N 0.37 1.23 0.30 0.00 -2.24 -1.26 -1.23 114.28 111.45 3itv n THR 95 Ca 0.05 -5.01 0.19 0.00 -2.27 0.00 0.00 64.05 57.01 3itv n THR 95 Cb 0.21 -0.79 0.86 0.00 -2.10 0.00 0.00 70.33 68.51 3itv n THR 95 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3itv h PRO 96 N 3.02 0.00 -6.62 -0.78 0.13 -1.86 -3.40 132.00 122.49 3itv h PRO 96 Ca 0.11 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.56 3itv h PRO 96 Cb 0.77 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 31.68 3itv h PRO 96 CO 0.64 0.00 -0.81 -0.80 -0.23 0.00 0.00 178.00 176.80 3itv s ASN 97 N -5.50 3.76 -0.04 1.44 0.01 -1.26 -0.17 114.94 113.18 3itv s ASN 97 Ca -0.01 -0.46 0.05 0.00 -0.71 0.00 0.00 52.86 51.72 3itv s ASN 97 Cb 0.10 -0.57 -0.03 0.00 0.41 0.00 0.00 41.25 41.17 3itv s ASN 97 CO 0.50 0.24 -0.16 -0.69 -1.51 0.00 0.00 177.10 175.48 3itv s VAL 98 N -0.95 2.91 -0.23 1.60 1.01 -0.21 -1.54 120.40 122.98 3itv s VAL 98 Ca 0.15 -0.82 -0.13 0.00 0.00 0.00 0.00 61.98 61.18 3itv s VAL 98 Cb -0.10 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 3itv s VAL 98 CO 0.06 0.57 0.29 -0.44 0.00 0.00 0.00 175.10 175.57 3itv s SER 99 N -0.78 6.25 0.15 3.32 0.01 0.14 -0.45 113.70 122.34 3itv s SER 99 Ca 0.12 0.28 -0.01 0.00 1.31 0.00 0.00 55.95 57.64 3itv s SER 99 Cb -0.11 -2.17 -0.05 0.00 0.21 0.00 0.00 66.02 63.91 3itv s SER 99 CO 0.01 -0.04 0.34 -0.76 0.41 0.00 0.00 173.24 173.19 3itv s LEU 100 N 1.39 4.28 -0.10 2.44 1.43 -1.24 -1.72 118.68 125.15 3itv s LEU 100 Ca 0.13 0.41 0.03 0.00 -1.03 0.00 0.00 54.13 53.66 3itv s LEU 100 Cb -0.15 -3.14 0.01 0.00 0.03 0.00 0.00 46.19 42.94 3itv s LEU 100 CO 0.07 0.04 -0.19 -2.28 0.23 0.00 0.00 176.35 174.23 3itv s HIS 101 N -1.72 2.17 -0.07 0.29 2.46 -1.26 -1.23 115.29 115.93 3itv s HIS 101 Ca 0.38 -0.94 0.00 0.00 0.47 0.00 0.00 55.06 54.98 3itv s HIS 101 Cb -0.12 -1.50 -0.03 0.00 -0.13 0.00 0.00 32.58 30.80 3itv s HIS 101 CO 0.27 -0.43 -0.06 0.42 -2.47 0.00 0.00 174.74 172.47 3itv s ILE 102 N 0.65 3.75 -1.99 0.89 -1.09 -0.44 0.07 121.20 123.04 3itv s ILE 102 Ca -0.13 -0.46 0.31 0.00 -2.23 0.00 0.00 60.65 58.14 3itv s ILE 102 Cb -0.16 -2.54 0.79 0.00 -1.58 0.00 0.00 42.46 38.96 3itv s ILE 102 CO 0.04 0.60 2.12 -0.81 -1.23 0.00 0.00 174.94 175.65 3itv n PRO 103 N 2.26 1.02 -0.25 2.79 -0.04 -1.26 -2.53 135.00 136.98 3itv n PRO 103 Ca -0.18 -0.16 0.06 0.00 -0.04 0.00 0.00 63.50 63.18 3itv n PRO 103 Cb 0.53 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.68 3itv n PRO 103 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3itv h TRP 104 N 0.39 0.21 -0.67 0.54 6.55 -1.90 -1.14 115.95 119.92 3itv h TRP 104 Ca 0.00 0.05 -0.12 0.00 0.95 0.00 0.00 58.89 59.77 3itv h TRP 104 Cb 0.13 0.03 -0.07 0.00 -0.86 0.00 0.00 29.16 28.38 3itv h TRP 104 CO 0.00 -0.13 0.15 -0.25 -1.05 0.00 0.00 178.44 177.15 3itv n ASP 105 N -5.21 5.31 -4.72 -3.49 8.00 0.11 -4.74 116.55 111.81 3itv n ASP 105 Ca 0.15 -3.08 -0.42 0.00 0.71 0.00 0.00 54.79 52.14 3itv n ASP 105 Cb 0.48 -0.72 -0.03 0.00 -0.02 0.00 0.00 41.12 40.83 3itv n ASP 105 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3itv s LYS 106 N -2.89 4.13 0.12 -1.24 2.47 -0.43 -4.92 119.74 116.98 3itv s LYS 106 Ca 0.55 2.58 -0.26 0.00 -1.56 0.00 0.00 55.97 57.28 3itv s LYS 106 Cb 0.43 -3.07 0.08 0.00 -1.46 0.00 0.00 37.83 33.80 3itv s LYS 106 CO 0.15 -0.72 1.05 0.00 0.16 0.00 0.00 175.35 175.98 3itv s ALA 107 N 1.01 -1.79 -0.06 3.13 0.00 -1.26 -4.98 121.76 117.81 3itv s ALA 107 Ca 0.73 0.22 -0.29 0.00 0.00 0.00 0.00 51.96 52.62 3itv s ALA 107 Cb -0.49 0.58 -0.07 0.00 0.00 0.00 0.00 23.12 23.14 3itv s ALA 107 CO 0.34 -1.05 2.05 0.34 0.00 0.00 0.00 175.76 177.44 3itv s ASP 108 N -2.99 6.10 0.31 0.00 2.15 -1.26 -4.85 116.67 116.13 3itv s ASP 108 Ca 0.13 2.37 0.08 0.00 0.43 0.00 0.00 52.55 55.57 3itv s ASP 108 Cb 0.00 -2.52 0.84 0.00 -0.30 0.00 0.00 42.92 40.94 3itv s ASP 108 CO 0.01 -1.38 1.74 -0.65 -0.17 0.00 0.00 175.17 174.72 3itv h PRO 109 N 12.17 0.59 -0.49 4.34 0.11 -1.96 0.25 132.00 147.02 3itv h PRO 109 Ca -0.46 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 3itv h PRO 109 Cb 1.24 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 3itv h PRO 109 CO 0.95 0.39 -0.05 0.87 -0.21 0.00 0.00 178.00 179.95 3itv h LYS 110 N 0.61 0.85 -0.34 1.05 1.57 -1.88 -0.73 116.57 117.69 3itv h LYS 110 Ca 0.62 -0.26 -0.17 0.00 -1.87 0.00 0.00 60.65 58.98 3itv h LYS 110 Cb 1.14 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.36 3itv h LYS 110 CO -0.46 0.88 -0.44 0.93 -0.57 0.00 0.00 179.45 179.79 3itv h GLU 111 N 0.78 0.89 -0.01 3.15 5.08 -1.39 -1.09 114.58 122.00 3itv h GLU 111 Ca 0.14 -0.51 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 3itv h GLU 111 Cb 0.54 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 3itv h GLU 111 CO 0.03 1.16 0.00 -0.07 -1.00 0.00 0.00 179.01 179.13 3itv h LEU 112 N 0.69 0.01 -1.04 1.33 3.38 -0.97 0.10 115.31 118.82 3itv h LEU 112 Ca 0.04 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.03 3itv h LEU 112 Cb 1.05 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.73 3itv h LEU 112 CO 0.10 0.03 0.64 0.50 0.09 0.00 0.00 178.44 179.81 3itv h LYS 113 N -0.02 1.18 -0.22 1.13 1.63 -1.10 -0.66 116.57 118.52 3itv h LYS 113 Ca 0.00 -0.07 -0.02 0.00 -0.85 0.00 0.00 60.65 59.71 3itv h LYS 113 Cb 0.02 -0.27 -0.01 0.00 -0.60 0.00 0.00 32.23 31.38 3itv h LYS 113 CO -0.00 0.78 0.06 0.00 -3.45 0.00 0.00 179.45 176.84 3itv h ALA 114 N 1.44 0.29 -0.66 5.00 0.00 -0.63 -1.23 119.26 123.46 3itv h ALA 114 Ca 0.40 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 3itv h ALA 114 Cb 0.06 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3itv h ALA 114 CO -0.14 -0.06 0.16 -0.09 0.00 0.00 0.00 179.25 179.12 3itv h ARG 115 N 0.18 1.06 -0.03 0.00 9.65 -0.61 -1.78 114.38 122.85 3itv h ARG 115 Ca 0.07 -0.26 -0.00 0.00 -1.10 0.00 0.00 59.98 58.69 3itv h ARG 115 Cb 0.27 -0.14 -0.00 0.00 -1.39 0.00 0.00 29.97 28.71 3itv h ARG 115 CO 0.00 0.95 0.02 0.78 2.80 0.00 0.00 179.97 184.52 3itv h GLY 116 N 0.99 0.05 1.42 2.80 0.00 -1.01 -1.36 103.07 105.95 3itv h GLY 116 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.52 3itv h GLY 116 CO 0.00 0.02 0.36 -0.55 0.00 0.00 0.00 176.54 176.37 3itv h ASP 117 N -0.02 0.68 0.69 0.19 3.32 -1.10 0.10 116.42 120.28 3itv h ASP 117 Ca 0.01 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 3itv h ASP 117 Cb 0.07 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 3itv h ASP 117 CO -0.00 0.51 -0.56 0.00 -1.72 0.00 0.00 179.24 177.47 3itv h ALA 118 N 1.61 0.97 -0.00 3.45 0.00 -1.03 -3.12 119.26 121.13 3itv h ALA 118 Ca 0.21 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3itv h ALA 118 Cb -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3itv h ALA 118 CO -0.04 0.70 -0.51 1.28 0.00 0.00 0.00 179.25 180.68 3itv n LEU 119 N -3.73 0.91 -0.34 0.00 4.77 -0.54 -4.94 117.00 113.14 3itv n LEU 119 Ca -0.01 -0.25 -0.01 0.00 -0.03 0.00 0.00 56.01 55.72 3itv n LEU 119 Cb 0.59 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 3itv n LEU 119 CO 0.41 0.19 -0.00 0.61 -1.33 0.00 0.00 177.39 177.27 3itv n GLY 120 N 1.44 0.59 3.30 -0.72 0.00 -0.27 -4.92 105.19 104.61 3itv n GLY 120 Ca 0.08 -0.76 -0.27 0.00 0.00 0.00 0.00 46.02 45.07 3itv n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3itv s LEU 121 N -0.71 2.18 0.00 0.99 1.43 0.19 -4.88 118.68 117.88 3itv s LEU 121 Ca 0.01 -0.57 0.03 0.00 -1.03 0.00 0.00 54.13 52.58 3itv s LEU 121 Cb -0.00 -1.11 0.03 0.00 0.03 0.00 0.00 46.19 45.14 3itv s LEU 121 CO 0.01 0.20 0.25 0.61 0.23 0.00 0.00 176.35 177.65 3itv n GLY 122 N 1.75 3.03 3.20 -3.19 0.00 0.76 -3.95 105.19 106.79 3itv n GLY 122 Ca -0.17 -2.29 -0.30 0.00 0.00 0.00 0.00 46.02 43.25 3itv n GLY 122 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3itv s PHE 123 N -2.29 2.32 0.00 1.61 0.40 -1.26 -1.04 117.98 117.71 3itv s PHE 123 Ca 0.19 -0.86 0.00 0.00 -0.60 0.00 0.00 56.93 55.66 3itv s PHE 123 Cb -0.01 -1.55 0.00 0.00 0.51 0.00 0.00 43.02 41.96 3itv s PHE 123 CO 0.12 -0.33 0.00 -3.47 0.70 0.00 0.00 175.22 172.24 3itv n ASP 124 N 3.39 0.00 -4.73 1.36 -0.08 0.40 -4.31 116.55 112.59 3itv n ASP 124 Ca -0.19 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.67 3itv n ASP 124 Cb 0.53 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 43.99 3itv n ASP 124 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3itv n ALA 125 N -3.00 1.68 -1.80 -1.67 0.00 -1.26 -4.54 120.51 109.93 3itv n ALA 125 Ca 0.00 0.33 -0.33 0.00 0.00 0.00 0.00 53.44 53.45 3itv n ALA 125 Cb 0.00 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.10 3itv n ALA 125 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3itv s MET 126 N -2.04 3.84 -0.11 0.00 -1.94 0.54 -3.73 119.30 115.86 3itv s MET 126 Ca 0.56 1.08 0.01 0.00 -1.71 0.00 0.00 55.69 55.63 3itv s MET 126 Cb -0.52 -2.12 0.02 0.00 2.01 0.00 0.00 34.83 34.22 3itv s MET 126 CO 0.62 -0.36 -0.13 -0.80 -0.01 0.00 0.00 175.02 174.33 3itv s ASN 127 N -2.74 2.32 0.51 3.03 0.01 -0.36 -0.14 114.94 117.57 3itv s ASN 127 Ca 0.61 -0.39 -0.06 0.00 -0.71 0.00 0.00 52.86 52.32 3itv s ASN 127 Cb -0.12 -1.01 -0.03 0.00 0.41 0.00 0.00 41.25 40.50 3itv s ASN 127 CO 0.28 -0.02 0.82 -0.94 -1.51 0.00 0.00 177.10 175.73 3itv s SER 128 N 1.18 6.17 -0.34 -1.22 1.04 -1.16 -1.32 113.70 118.05 3itv s SER 128 Ca -0.03 0.93 -0.00 0.00 0.48 0.00 0.00 55.95 57.33 3itv s SER 128 Cb -0.14 -2.19 0.11 0.00 0.10 0.00 0.00 66.02 63.90 3itv s SER 128 CO -0.04 -0.66 0.15 0.21 0.98 0.00 0.00 173.24 173.88 3itv s ASN 129 N -4.14 3.72 -0.21 7.02 3.84 -1.05 -4.67 114.94 119.45 3itv s ASN 129 Ca 0.49 -1.91 0.13 0.00 0.21 0.00 0.00 52.86 51.78 3itv s ASN 129 Cb -0.10 -0.77 0.44 0.00 -0.55 0.00 0.00 41.25 40.27 3itv s ASN 129 CO 0.46 -0.37 1.19 0.35 -2.79 0.00 0.00 177.10 175.94 3itv n THR 130 N 4.47 1.93 -0.22 -5.21 -2.24 -1.26 -4.63 114.28 107.12 3itv n THR 130 Ca 0.02 -3.22 0.03 0.00 -2.27 0.00 0.00 64.05 58.62 3itv n THR 130 Cb 0.39 -0.21 0.09 0.00 -2.10 0.00 0.00 70.33 68.50 3itv n THR 130 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 3itv n PHE 131 N -0.73 0.24 -3.54 4.78 1.16 -1.26 -4.60 117.46 113.52 3itv n PHE 131 Ca 0.24 -0.57 -0.13 0.00 -1.87 0.00 0.00 57.45 55.12 3itv n PHE 131 Cb 0.85 -0.07 -0.04 0.00 -1.61 0.00 0.00 39.48 38.61 3itv n PHE 131 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 3itv s SER 132 N -1.22 -0.47 -0.12 5.98 1.04 -1.26 -4.93 113.70 112.73 3itv s SER 132 Ca 0.14 0.11 -0.12 0.00 0.48 0.00 0.00 55.95 56.57 3itv s SER 132 Cb 0.09 0.52 -0.05 0.00 0.10 0.00 0.00 66.02 66.69 3itv s SER 132 CO 0.07 -0.79 0.26 -1.81 0.98 0.00 0.00 173.24 171.94 3itv s ASP 133 N -2.22 6.49 0.21 7.02 1.01 -1.26 -4.84 116.67 123.08 3itv s ASP 133 Ca -0.03 0.57 0.04 0.00 0.71 0.00 0.00 52.55 53.85 3itv s ASP 133 Cb -0.00 -2.16 -0.03 0.00 1.01 0.00 0.00 42.92 41.74 3itv s ASP 133 CO -0.05 0.25 0.32 0.00 0.21 0.00 0.00 175.17 175.90 3itv s ALA 134 N -0.34 3.90 0.45 5.23 0.00 -1.26 -5.06 121.76 124.68 3itv s ALA 134 Ca 0.17 -1.19 -0.25 0.00 0.00 0.00 0.00 51.96 50.68 3itv s ALA 134 Cb -0.13 -1.69 -0.08 0.00 0.00 0.00 0.00 23.12 21.21 3itv s ALA 134 CO 0.05 0.33 1.43 -2.14 0.00 0.00 0.00 175.76 175.44 3itv s PRO 135 N -3.73 3.70 0.00 0.00 0.02 -1.26 -2.29 135.00 131.43 3itv s PRO 135 Ca 0.34 2.43 0.00 0.00 0.02 0.00 0.00 61.00 63.79 3itv s PRO 135 Cb -0.09 -2.67 0.00 0.00 0.02 0.00 0.00 34.50 31.76 3itv s PRO 135 CO 0.28 -0.81 0.00 0.41 -0.33 0.00 0.00 177.00 176.55 3itv n GLY 136 N 0.57 0.52 3.71 0.52 0.00 -1.26 -4.98 105.19 104.27 3itv n GLY 136 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3itv n GLY 136 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3itv s GLN 137 N -0.40 4.31 0.11 1.61 0.74 -0.97 -4.94 119.66 120.12 3itv s GLN 137 Ca 0.00 2.06 -0.14 0.00 0.05 0.00 0.00 55.36 57.33 3itv s GLN 137 Cb 0.00 -3.30 -0.08 0.00 1.10 0.00 0.00 33.01 30.74 3itv s GLN 137 CO 0.00 -0.46 1.44 0.00 -0.55 0.00 0.00 175.29 175.72 3itv h ALA 138 N 6.96 0.45 -3.70 1.58 0.00 -1.93 -3.44 119.26 119.17 3itv h ALA 138 Ca -0.42 -0.40 -0.64 0.00 0.00 0.00 0.00 54.91 53.46 3itv h ALA 138 Cb 1.21 -0.10 -0.32 0.00 0.00 0.00 0.00 17.79 18.58 3itv h ALA 138 CO 0.87 0.46 -0.86 -1.01 0.00 0.00 0.00 179.25 178.70 3itv s HIS 139 N -4.40 2.21 0.39 0.00 3.76 -1.26 -5.13 115.29 110.86 3itv s HIS 139 Ca -0.12 -0.76 -0.23 0.00 -0.15 0.00 0.00 55.06 53.80 3itv s HIS 139 Cb 0.09 -1.48 -0.10 0.00 1.11 0.00 0.00 32.58 32.20 3itv s HIS 139 CO 0.83 -0.28 0.96 0.45 -0.85 0.00 0.00 174.74 175.85 3itv s SER 140 N 0.14 7.04 -0.14 1.40 0.15 -1.26 -4.96 113.70 116.06 3itv s SER 140 Ca -0.10 1.79 0.16 0.00 0.70 0.00 0.00 55.95 58.49 3itv s SER 140 Cb -0.15 -2.56 0.70 0.00 -1.71 0.00 0.00 66.02 62.30 3itv s SER 140 CO 0.05 -0.29 1.59 -1.22 1.20 0.00 0.00 173.24 174.57 3itv n TYR 141 N -0.17 1.56 -0.23 3.44 4.01 -1.26 -4.56 117.16 119.95 3itv n TYR 141 Ca 0.05 -0.59 0.04 0.00 -0.16 0.00 0.00 57.90 57.24 3itv n TYR 141 Cb 0.52 -0.31 0.16 0.00 -0.31 0.00 0.00 39.34 39.39 3itv n TYR 141 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3itv h LYS 142 N 3.75 0.24 -0.51 -0.72 3.64 -1.94 -1.42 116.57 119.61 3itv h LYS 142 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3itv h LYS 142 Cb 1.53 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.29 3itv h LYS 142 CO 0.29 0.16 0.00 0.66 -2.27 0.00 0.00 179.45 178.29 3itv n TYR 143 N -5.17 1.78 0.00 1.91 4.01 -1.26 -5.05 117.16 113.38 3itv n TYR 143 Ca 0.12 -0.75 0.00 0.00 -0.16 0.00 0.00 57.90 57.11 3itv n TYR 143 Cb 0.42 -0.45 0.00 0.00 -0.31 0.00 0.00 39.34 39.00 3itv n TYR 143 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3itv n GLY 144 N 0.41 1.50 0.00 2.72 0.00 -0.54 -4.67 105.19 104.62 3itv n GLY 144 Ca 0.26 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 44.18 3itv n GLY 144 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3itv n SER 145 N 0.00 0.00 0.31 1.61 3.41 -1.26 -4.27 113.62 113.42 3itv n SER 145 Ca 0.00 0.00 0.19 0.00 -0.26 0.00 0.00 58.87 58.80 3itv n SER 145 Cb 0.00 0.00 0.98 0.00 -0.26 0.00 0.00 64.21 64.93 3itv n SER 145 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3itv h LEU 146 N 0.00 0.00 -3.01 1.04 3.38 -1.87 -2.31 115.31 112.55 3itv h LEU 146 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3itv h LEU 146 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3itv h LEU 146 CO 0.00 0.03 0.00 -1.54 0.09 0.00 0.00 178.44 177.02 3itv n SER 147 N -3.31 2.75 -4.73 -0.43 3.41 -1.26 -3.85 113.62 106.19 3itv n SER 147 Ca -0.02 -2.36 -0.37 0.00 -0.26 0.00 0.00 58.87 55.86 3itv n SER 147 Cb 0.15 -0.25 0.06 0.00 -0.26 0.00 0.00 64.21 63.91 3itv n SER 147 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3itv n HIS 148 N -0.28 2.04 0.21 7.33 -0.00 -0.87 -4.80 115.22 118.85 3itv n HIS 148 Ca 0.11 0.42 0.06 0.00 -0.00 0.00 0.00 57.72 58.31 3itv n HIS 148 Cb 0.49 -2.30 0.46 0.00 -0.00 0.00 0.00 29.99 28.65 3itv n HIS 148 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 3itv h THR 149 N 0.79 0.97 -3.18 3.57 1.35 -1.91 -3.43 112.91 111.07 3itv h THR 149 Ca -0.51 -1.09 -0.59 0.00 -0.55 0.00 0.00 66.41 63.67 3itv h THR 149 Cb 1.33 1.63 -0.07 0.00 -1.73 0.00 0.00 68.15 69.31 3itv h THR 149 CO 0.54 0.28 0.63 0.21 -0.25 0.00 0.00 175.52 176.94 3itv s ASN 150 N -6.60 6.97 0.24 5.36 2.47 -1.26 -4.95 114.94 117.17 3itv s ASN 150 Ca -0.02 1.21 -0.05 0.00 0.42 0.00 0.00 52.86 54.42 3itv s ASN 150 Cb 0.13 -2.49 0.38 0.00 -1.45 0.00 0.00 41.25 37.82 3itv s ASN 150 CO 0.67 -0.59 1.80 0.00 -3.72 0.00 0.00 177.10 175.27 3itv h ALA 151 N 7.55 1.12 -0.39 1.71 0.00 -1.99 -1.78 119.26 125.47 3itv h ALA 151 Ca -0.21 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3itv h ALA 151 Cb 1.08 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3itv h ALA 151 CO 0.92 0.06 0.07 0.00 0.00 0.00 0.00 179.25 180.30 3itv h ALA 152 N 1.45 1.40 -0.34 0.00 0.00 -1.96 -0.82 119.26 118.97 3itv h ALA 152 Ca 0.38 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.98 3itv h ALA 152 Cb 0.36 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3itv h ALA 152 CO -0.25 0.43 -0.33 1.15 0.00 0.00 0.00 179.25 180.25 3itv h THR 153 N 0.57 1.28 -0.75 0.00 2.02 -1.70 -1.28 112.91 113.05 3itv h THR 153 Ca 0.13 -1.50 -0.05 0.00 0.77 0.00 0.00 66.41 65.75 3itv h THR 153 Cb 0.26 1.47 -0.03 0.00 -1.74 0.00 0.00 68.15 68.10 3itv h THR 153 CO 0.00 0.49 0.25 0.03 0.37 0.00 0.00 175.52 176.67 3itv h ARG 154 N 0.62 1.15 -0.76 6.66 3.08 -0.99 -1.59 114.38 122.54 3itv h ARG 154 Ca 0.06 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 59.82 3itv h ARG 154 Cb 0.92 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.76 3itv h ARG 154 CO 0.08 0.96 0.27 0.00 -1.07 0.00 0.00 179.97 180.21 3itv h ALA 155 N 1.16 1.00 -0.71 0.04 0.00 -1.00 -0.38 119.26 119.36 3itv h ALA 155 Ca 0.24 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3itv h ALA 155 Cb 0.28 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3itv h ALA 155 CO -0.01 0.66 0.26 0.37 0.00 0.00 0.00 179.25 180.52 3itv h GLN 156 N 1.12 1.08 -0.56 0.00 4.15 -0.85 -0.46 115.11 119.60 3itv h GLN 156 Ca 0.25 -0.21 -0.11 0.00 0.77 0.00 0.00 58.65 59.35 3itv h GLN 156 Cb 0.27 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 3itv h GLN 156 CO -0.01 0.91 -0.08 0.00 -1.93 0.00 0.00 178.83 177.72 3itv h ALA 157 N 1.12 0.81 -0.25 3.38 0.00 -0.89 -1.63 119.26 121.80 3itv h ALA 157 Ca 0.23 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3itv h ALA 157 Cb 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3itv h ALA 157 CO -0.01 0.67 0.09 0.28 0.00 0.00 0.00 179.25 180.28 3itv h VAL 158 N 0.92 1.18 -0.93 0.00 2.07 -0.76 -2.23 116.25 116.50 3itv h VAL 158 Ca 0.15 -0.55 0.03 0.00 0.82 0.00 0.00 66.70 67.15 3itv h VAL 158 Cb 0.64 1.07 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 3itv h VAL 158 CO 0.04 0.18 0.61 -0.08 0.02 0.00 0.00 177.57 178.35 3itv h GLU 159 N 0.25 1.15 -0.42 1.57 4.57 -0.92 -1.21 114.58 119.59 3itv h GLU 159 Ca 0.08 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.19 3itv h GLU 159 Cb 0.20 -0.26 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 3itv h GLU 159 CO -0.01 0.76 0.24 1.25 -1.18 0.00 0.00 179.01 180.08 3itv h HIS 160 N 1.19 0.57 -0.65 0.92 2.76 -1.00 -0.87 115.15 118.06 3itv h HIS 160 Ca 0.36 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.48 3itv h HIS 160 Cb -0.02 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 28.73 3itv h HIS 160 CO -0.00 0.42 0.24 -0.91 -1.30 0.00 0.00 177.93 176.38 3itv h ASN 161 N 0.55 0.89 -0.02 3.26 2.35 -0.78 -1.23 115.58 120.60 3itv h ASN 161 Ca 0.15 -0.14 -0.07 0.00 -0.55 0.00 0.00 56.30 55.69 3itv h ASN 161 Cb 0.03 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 3itv h ASN 161 CO -0.03 0.82 -0.19 -0.07 -1.65 0.00 0.00 177.43 176.31 3itv h LEU 162 N 0.95 0.37 -0.83 1.61 3.38 -0.84 -1.80 115.31 118.15 3itv h LEU 162 Ca 0.22 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 3itv h LEU 162 Cb 0.22 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3itv h LEU 162 CO -0.02 0.58 -0.16 -0.08 0.09 0.00 0.00 178.44 178.85 3itv h GLU 163 N 0.34 0.71 -0.55 1.13 4.81 -0.24 -1.71 114.58 119.08 3itv h GLU 163 Ca 0.06 -0.25 -0.06 0.00 -0.13 0.00 0.00 59.36 58.98 3itv h GLU 163 Cb 0.54 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 3itv h GLU 163 CO 0.04 0.83 0.10 0.00 -0.73 0.00 0.00 179.01 179.24 3itv h ILE 165 N 0.82 1.20 -0.70 0.00 2.04 -0.91 -0.63 117.51 119.34 3itv h ILE 165 Ca 0.17 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.38 3itv h ILE 165 Cb 0.35 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 3itv h ILE 165 CO 0.00 0.23 0.45 -0.33 0.00 0.00 0.00 178.15 178.51 3itv h GLU 166 N 0.45 0.93 -0.57 2.37 4.39 -0.84 0.56 114.58 121.87 3itv h GLU 166 Ca 0.12 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.69 3itv h GLU 166 Cb 0.23 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 3itv h GLU 166 CO -0.01 0.63 0.08 0.82 -1.16 0.00 0.00 179.01 179.37 3itv h ILE 167 N 0.95 1.26 -0.70 3.13 1.08 -1.11 -2.77 117.51 119.35 3itv h ILE 167 Ca 0.26 -0.99 -0.03 0.00 -0.39 0.00 0.00 64.86 63.70 3itv h ILE 167 Cb -0.09 0.79 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 3itv h ILE 167 CO -0.05 0.36 0.33 1.23 -0.69 0.00 0.00 178.15 179.33 3itv h GLY 168 N 0.85 1.08 1.42 5.37 0.00 -0.50 -2.47 103.07 108.82 3itv h GLY 168 Ca 0.17 -0.55 0.01 0.00 0.00 0.00 0.00 47.33 46.96 3itv h GLY 168 CO 0.01 0.52 0.39 0.50 0.00 0.00 0.00 176.54 177.96 3itv h LYS 169 N 0.98 0.76 0.00 4.80 1.57 -0.74 0.11 116.57 124.04 3itv h LYS 169 Ca 0.24 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.92 3itv h LYS 169 Cb 0.13 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 3itv h LYS 169 CO -0.03 0.50 -0.25 0.00 -0.57 0.00 0.00 179.45 179.10 3itv h ALA 170 N 1.64 0.93 -0.01 3.86 0.00 -1.17 -3.30 119.26 121.20 3itv h ALA 170 Ca 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3itv h ALA 170 Cb -0.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3itv h ALA 170 CO -0.05 0.32 -0.18 0.44 0.00 0.00 0.00 179.25 179.78 3itv n ILE 171 N -3.29 0.00 0.00 0.00 -5.35 -0.91 -4.83 119.36 104.97 3itv n ILE 171 Ca 0.01 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.08 3itv n ILE 171 Cb 0.51 1.22 0.00 0.00 -1.74 0.00 0.00 39.64 39.63 3itv n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3itv n GLY 172 N 0.98 0.95 3.80 3.28 0.00 -0.68 -4.67 105.19 108.85 3itv n GLY 172 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 3itv n GLY 172 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3itv s SER 173 N -2.14 5.46 -0.05 1.61 0.15 -0.06 -4.78 113.70 113.90 3itv s SER 173 Ca 0.00 1.80 0.13 0.00 0.70 0.00 0.00 55.95 58.58 3itv s SER 173 Cb 0.00 -2.53 0.24 0.00 -1.71 0.00 0.00 66.02 62.03 3itv s SER 173 CO 0.00 -1.39 1.11 0.29 1.20 0.00 0.00 173.24 174.45 3itv n LYS 174 N -2.50 0.38 -3.53 5.44 4.76 -1.26 -4.49 118.16 116.97 3itv n LYS 174 Ca 0.09 -1.87 -0.11 0.00 -2.87 0.00 0.00 58.31 53.56 3itv n LYS 174 Cb 0.53 -0.61 -0.04 0.00 -1.84 0.00 0.00 35.03 33.07 3itv n LYS 174 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3itv s ALA 175 N -0.82 -1.85 -0.11 7.82 0.00 -1.26 -2.20 121.76 123.34 3itv s ALA 175 Ca 0.21 1.26 0.01 0.00 0.00 0.00 0.00 51.96 53.45 3itv s ALA 175 Cb 0.22 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.29 3itv s ALA 175 CO -0.06 -0.50 -0.14 -1.17 0.00 0.00 0.00 175.76 173.88 3itv s LEU 176 N -1.79 1.66 -0.22 0.00 2.96 -0.71 -0.34 118.68 120.25 3itv s LEU 176 Ca 0.00 -0.42 -0.09 0.00 -0.22 0.00 0.00 54.13 53.41 3itv s LEU 176 Cb -0.01 -1.07 -0.04 0.00 0.50 0.00 0.00 46.19 45.57 3itv s LEU 176 CO -0.03 -0.01 0.11 -0.89 -1.32 0.00 0.00 176.35 174.21 3itv s THR 177 N 1.12 4.95 -0.32 3.68 2.01 0.80 -0.52 115.64 127.35 3itv s THR 177 Ca -0.04 0.03 -0.03 0.00 0.31 0.00 0.00 61.69 61.96 3itv s THR 177 Cb -0.14 -3.28 0.05 0.00 0.01 0.00 0.00 72.50 69.13 3itv s THR 177 CO -0.03 0.38 0.04 -0.69 -0.69 0.00 0.00 174.62 173.63 3itv s VAL 178 N 0.93 3.27 -0.11 3.82 1.01 0.15 -2.99 120.40 126.48 3itv s VAL 178 Ca 0.06 -1.32 0.02 0.00 0.00 0.00 0.00 61.98 60.73 3itv s VAL 178 Cb -0.13 -2.88 0.01 0.00 0.00 0.00 0.00 36.38 33.38 3itv s VAL 178 CO 0.03 -0.15 -0.17 0.86 0.00 0.00 0.00 175.10 175.67 3itv s TRP 179 N 1.30 2.10 0.21 5.22 -0.00 -1.26 -2.18 118.94 124.33 3itv s TRP 179 Ca -0.04 -1.00 0.08 0.00 -0.00 0.00 0.00 56.10 55.14 3itv s TRP 179 Cb -0.20 -1.50 -0.05 0.00 -0.00 0.00 0.00 33.47 31.73 3itv s TRP 179 CO 0.00 -0.50 -0.14 0.96 -0.00 0.00 0.00 176.95 177.27 3itv s ILE 180 N 0.93 1.75 -1.62 5.86 -4.36 -1.26 -4.70 121.20 117.80 3itv s ILE 180 Ca -0.07 -2.22 0.26 0.00 -0.26 0.00 0.00 60.65 58.36 3itv s ILE 180 Cb -0.15 -2.06 0.22 0.00 1.25 0.00 0.00 42.46 41.72 3itv s ILE 180 CO -0.01 -0.59 1.53 0.61 0.24 0.00 0.00 174.94 176.72 3itv n GLY 181 N -0.39 -0.71 3.01 6.27 0.00 -1.26 -4.95 105.19 107.16 3itv n GLY 181 Ca -0.08 -0.40 -0.53 0.00 0.00 0.00 0.00 46.02 45.01 3itv n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3itv n ASP 182 N -0.79 0.60 0.00 1.61 9.92 -1.26 -4.10 116.55 122.52 3itv n ASP 182 Ca 0.11 0.97 0.00 0.00 -0.53 0.00 0.00 54.79 55.34 3itv n ASP 182 Cb 0.35 -0.74 0.00 0.00 -0.64 0.00 0.00 41.12 40.09 3itv n ASP 182 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3itv n GLY 183 N 2.47 -0.56 3.06 0.44 0.00 -1.26 -1.53 105.19 107.82 3itv n GLY 183 Ca 0.22 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.46 3itv n GLY 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3itv s SER 184 N -4.00 0.53 0.00 1.61 1.04 0.60 -4.90 113.70 108.58 3itv s SER 184 Ca 0.00 -0.82 0.14 0.00 0.48 0.00 0.00 55.95 55.76 3itv s SER 184 Cb 0.00 0.14 -0.03 0.00 0.10 0.00 0.00 66.02 66.24 3itv s SER 184 CO 0.00 -0.46 0.76 0.59 0.98 0.00 0.00 173.24 175.11 3itv n ASN 185 N 0.64 1.37 -3.89 7.02 4.13 -1.26 -1.23 115.26 122.05 3itv n ASN 185 Ca -0.17 -1.19 -0.11 0.00 1.68 0.00 0.00 54.58 54.79 3itv n ASN 185 Cb 0.59 0.55 -0.13 0.00 -1.54 0.00 0.00 39.78 39.24 3itv n ASN 185 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3itv s PHE 186 N -1.83 0.05 0.33 3.10 0.08 -1.26 -4.36 117.98 114.09 3itv s PHE 186 Ca 0.11 -0.10 -0.29 0.00 0.12 0.00 0.00 56.93 56.77 3itv s PHE 186 Cb 0.11 -0.04 -0.11 0.00 -0.57 0.00 0.00 43.02 42.41 3itv s PHE 186 CO 0.39 -0.04 1.55 -2.30 -0.10 0.00 0.00 175.22 174.73 3itv n PRO 187 N 2.79 2.72 0.00 0.24 -0.02 -1.26 -1.77 135.00 137.70 3itv n PRO 187 Ca -0.14 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3itv n PRO 187 Cb 0.59 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 3itv n PRO 187 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3itv n GLY 188 N 1.36 3.08 0.31 -1.23 0.00 -1.26 -4.88 105.19 102.57 3itv n GLY 188 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3itv n GLY 188 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3itv h GLN 189 N 1.34 0.87 -6.71 1.61 4.15 -1.78 -3.42 115.11 111.16 3itv h GLN 189 Ca 0.00 -0.05 -0.66 0.00 0.77 0.00 0.00 58.65 58.71 3itv h GLN 189 Cb 0.00 -0.20 -0.22 0.00 0.21 0.00 0.00 27.48 27.27 3itv h GLN 189 CO 0.00 0.57 -0.86 -1.12 -1.93 0.00 0.00 178.83 175.49 3itv s SER 190 N -5.72 3.11 -0.42 -0.69 0.01 -1.26 -5.09 113.70 103.65 3itv s SER 190 Ca -0.13 -0.72 -0.18 0.00 1.31 0.00 0.00 55.95 56.23 3itv s SER 190 Cb 0.18 -0.21 0.02 0.00 0.21 0.00 0.00 66.02 66.22 3itv s SER 190 CO 0.78 0.16 0.49 0.21 0.41 0.00 0.00 173.24 175.29 3itv s ASN 191 N -1.94 6.24 0.21 2.44 3.84 -1.26 -4.96 114.94 119.51 3itv s ASN 191 Ca 0.12 -0.51 -0.14 0.00 0.21 0.00 0.00 52.86 52.54 3itv s ASN 191 Cb -0.10 -2.25 0.24 0.00 -0.55 0.00 0.00 41.25 38.59 3itv s ASN 191 CO 0.05 -0.61 1.62 -0.26 -2.79 0.00 0.00 177.10 175.11 3itv h PHE 192 N 8.73 -0.43 -0.01 0.43 0.04 -1.98 -0.88 116.94 122.84 3itv h PHE 192 Ca -0.26 0.06 -0.00 0.00 2.80 0.00 0.00 57.97 60.57 3itv h PHE 192 Cb 1.11 0.29 -0.00 0.00 2.20 0.00 0.00 35.95 39.55 3itv h PHE 192 CO 0.66 -0.30 0.00 1.15 -0.60 0.00 0.00 178.31 179.22 3itv h THR 193 N -0.02 1.23 -0.81 -1.55 2.02 -1.99 -2.16 112.91 109.64 3itv h THR 193 Ca 0.31 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 3itv h THR 193 Cb 0.50 1.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.55 3itv h THR 193 CO -0.69 0.18 0.45 0.03 0.37 0.00 0.00 175.52 175.86 3itv h ARG 194 N -0.26 1.12 -0.57 6.66 2.47 -1.92 0.10 114.38 121.98 3itv h ARG 194 Ca 0.00 -0.12 -0.04 0.00 -1.26 0.00 0.00 59.98 58.57 3itv h ARG 194 Cb 0.30 -0.22 -0.02 0.00 -1.65 0.00 0.00 29.97 28.37 3itv h ARG 194 CO 0.00 0.81 0.21 0.00 0.56 0.00 0.00 179.97 181.56 3itv h ALA 195 N 1.37 0.74 -0.37 0.04 0.00 -1.14 -1.22 119.26 118.68 3itv h ALA 195 Ca 0.29 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 3itv h ALA 195 Cb 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3itv h ALA 195 CO -0.05 0.37 -0.19 0.35 0.00 0.00 0.00 179.25 179.73 3itv h PHE 196 N 0.78 0.77 -0.57 0.00 3.57 -0.80 -1.52 116.94 119.17 3itv h PHE 196 Ca 0.19 -0.16 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 3itv h PHE 196 Cb 0.23 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 3itv h PHE 196 CO 0.01 0.83 0.19 0.93 -2.23 0.00 0.00 178.31 178.04 3itv h GLU 197 N 0.61 0.88 -0.69 1.11 5.08 -0.65 -0.58 114.58 120.34 3itv h GLU 197 Ca 0.09 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 3itv h GLU 197 Cb 0.66 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 3itv h GLU 197 CO 0.05 0.78 0.31 0.00 -1.00 0.00 0.00 179.01 179.15 3itv h ARG 198 N 0.80 1.01 -0.18 2.33 3.08 -0.96 -1.61 114.38 118.85 3itv h ARG 198 Ca 0.19 -0.17 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 3itv h ARG 198 Cb 0.26 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 3itv h ARG 198 CO -0.01 0.82 0.11 -0.92 -1.07 0.00 0.00 179.97 178.90 3itv h TYR 199 N 0.97 0.23 -0.87 3.04 5.03 -0.93 -1.64 116.97 122.80 3itv h TYR 199 Ca 0.23 0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.56 3itv h TYR 199 Cb 0.16 -0.08 -0.04 0.00 1.55 0.00 0.00 36.73 38.32 3itv h TYR 199 CO 0.01 0.18 0.58 -0.07 -1.32 0.00 0.00 178.16 177.54 3itv h LEU 200 N 0.22 1.00 -0.61 2.82 3.38 -0.84 -0.47 115.31 120.80 3itv h LEU 200 Ca 0.06 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 3itv h LEU 200 Cb 0.01 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 3itv h LEU 200 CO -0.01 0.72 0.06 -1.28 0.09 0.00 0.00 178.44 178.01 3itv h SER 201 N 1.18 1.01 -0.36 -0.43 0.87 -1.07 -1.49 113.55 113.25 3itv h SER 201 Ca 0.32 -0.28 -0.10 0.00 -1.23 0.00 0.00 61.79 60.50 3itv h SER 201 Cb -0.12 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.56 3itv h SER 201 CO -0.07 1.04 -0.16 0.00 -0.53 0.00 0.00 176.83 177.10 3itv h ALA 202 N 1.01 0.50 0.00 6.23 0.00 -0.90 -2.75 119.26 123.34 3itv h ALA 202 Ca 0.18 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3itv h ALA 202 Cb 0.48 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3itv h ALA 202 CO 0.02 0.42 -0.23 0.52 0.00 0.00 0.00 179.25 179.98 3itv h MET 203 N 0.53 0.00 -0.35 0.00 2.07 -1.00 -1.44 114.93 114.74 3itv h MET 203 Ca 0.08 0.00 -0.05 0.00 -2.07 0.00 0.00 59.70 57.66 3itv h MET 203 Cb 0.69 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.41 3itv h MET 203 CO 0.05 0.23 -0.01 0.00 1.07 0.00 0.00 176.91 178.25 3itv h ALA 204 N 1.77 1.33 -0.20 6.32 0.00 -0.98 0.18 119.26 127.68 3itv h ALA 204 Ca -0.00 -0.21 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 3itv h ALA 204 Cb 0.41 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3itv h ALA 204 CO 0.03 0.46 -0.56 0.93 0.00 0.00 0.00 179.25 180.11 3itv h GLU 205 N 0.53 0.61 -0.45 0.00 5.08 -1.08 -2.27 114.58 116.99 3itv h GLU 205 Ca 0.11 -0.39 -0.12 0.00 -1.00 0.00 0.00 59.36 57.96 3itv h GLU 205 Cb 0.35 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 3itv h GLU 205 CO 0.01 1.01 -0.19 0.82 -1.00 0.00 0.00 179.01 179.66 3itv h ILE 206 N 0.47 1.27 -0.87 3.13 2.04 -0.95 -2.92 117.51 119.69 3itv h ILE 206 Ca 0.01 -1.34 0.04 0.00 1.00 0.00 0.00 64.86 64.56 3itv h ILE 206 Cb 1.12 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 38.32 3itv h ILE 206 CO 0.11 0.46 0.57 0.22 0.00 0.00 0.00 178.15 179.51 3itv h TYR 207 N 0.77 1.03 0.00 1.37 5.03 -0.51 -1.19 116.97 123.47 3itv h TYR 207 Ca 0.10 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.42 3itv h TYR 207 Cb 0.76 -0.34 -0.00 0.00 1.55 0.00 0.00 36.73 38.69 3itv h TYR 207 CO 0.05 0.59 -0.08 0.87 -1.32 0.00 0.00 178.16 178.28 3itv h LYS 208 N 1.06 0.00 -0.22 1.82 1.57 -1.21 -2.10 116.57 117.49 3itv h LYS 208 Ca 0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 3itv h LYS 208 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3itv h LYS 208 CO -0.11 0.08 0.00 0.41 -0.57 0.00 0.00 179.45 179.26 3itv n GLY 209 N -1.08 0.58 3.72 3.86 0.00 -0.46 -4.92 105.19 106.89 3itv n GLY 209 Ca -0.02 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 3itv n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3itv s LEU 210 N -1.51 4.42 0.91 0.99 1.43 -0.79 -5.02 118.68 119.10 3itv s LEU 210 Ca 0.33 1.75 -0.11 0.00 -1.03 0.00 0.00 54.13 55.07 3itv s LEU 210 Cb 0.18 -3.58 0.14 0.00 0.03 0.00 0.00 46.19 42.96 3itv s LEU 210 CO 0.26 -0.21 1.11 -2.84 0.23 0.00 0.00 176.35 174.90 3itv s PRO 211 N 0.63 1.06 0.47 1.29 0.02 -1.26 -4.90 135.00 132.32 3itv s PRO 211 Ca 0.51 1.31 0.13 0.00 0.02 0.00 0.00 61.00 62.97 3itv s PRO 211 Cb -0.23 -1.75 1.09 0.00 0.02 0.00 0.00 34.50 33.63 3itv s PRO 211 CO 0.29 -2.52 2.09 0.22 -0.33 0.00 0.00 177.00 176.75 3itv h ASP 212 N -1.78 0.22 -0.60 2.53 3.58 -2.00 -2.34 116.42 116.04 3itv h ASP 212 Ca -0.46 -0.00 -0.11 0.00 0.42 0.00 0.00 57.03 56.88 3itv h ASP 212 Cb 1.27 -0.05 -0.06 0.00 1.72 0.00 0.00 39.33 42.20 3itv h ASP 212 CO 0.46 0.16 0.12 -0.90 -2.88 0.00 0.00 179.24 176.20 3itv n ASP 213 N -4.50 4.98 -4.79 2.28 5.75 -1.26 -4.97 116.55 114.04 3itv n ASP 213 Ca 0.01 -3.11 -0.22 0.00 -0.01 0.00 0.00 54.79 51.46 3itv n ASP 213 Cb 0.13 -0.69 -0.05 0.00 -1.03 0.00 0.00 41.12 39.47 3itv n ASP 213 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3itv s TRP 214 N -2.91 3.00 0.13 2.11 0.52 -0.88 -4.89 118.94 116.03 3itv s TRP 214 Ca 0.53 -0.16 0.10 0.00 0.02 0.00 0.00 56.10 56.59 3itv s TRP 214 Cb 0.42 -1.41 -0.04 0.00 -1.15 0.00 0.00 33.47 31.29 3itv s TRP 214 CO 0.13 0.50 -0.25 0.15 0.02 0.00 0.00 176.95 177.51 3itv s LYS 215 N -3.83 1.32 -0.22 4.98 -0.14 -0.93 -4.84 119.74 116.07 3itv s LYS 215 Ca 0.34 -1.30 0.01 0.00 -1.36 0.00 0.00 55.97 53.66 3itv s LYS 215 Cb -0.07 -1.73 0.04 0.00 -1.68 0.00 0.00 37.83 34.39 3itv s LYS 215 CO 0.24 0.40 -0.14 -1.17 -0.76 0.00 0.00 175.35 173.93 3itv s LEU 216 N -2.05 2.81 -0.20 3.17 2.96 0.50 -1.73 118.68 124.13 3itv s LEU 216 Ca 0.12 -0.96 -0.07 0.00 -0.22 0.00 0.00 54.13 53.01 3itv s LEU 216 Cb -0.10 -1.54 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 3itv s LEU 216 CO 0.06 -0.09 0.04 -0.36 -1.32 0.00 0.00 176.35 174.68 3itv s PHE 217 N 1.23 3.14 -0.12 5.38 0.08 0.32 -0.94 117.98 127.06 3itv s PHE 217 Ca -0.01 -0.20 -0.04 0.00 0.12 0.00 0.00 56.93 56.80 3itv s PHE 217 Cb -0.16 -2.11 -0.04 0.00 -0.57 0.00 0.00 43.02 40.14 3itv s PHE 217 CO -0.08 -0.08 0.05 -1.54 -0.10 0.00 0.00 175.22 173.46 3itv s SER 218 N 0.85 5.59 -0.23 1.36 1.04 -0.87 0.32 113.70 121.76 3itv s SER 218 Ca 0.03 0.20 -0.02 0.00 0.48 0.00 0.00 55.95 56.63 3itv s SER 218 Cb -0.14 -1.75 0.01 0.00 0.10 0.00 0.00 66.02 64.25 3itv s SER 218 CO 0.02 0.33 -0.08 -0.70 0.98 0.00 0.00 173.24 173.80 3itv s GLU 219 N -0.57 3.04 0.51 4.02 2.12 -0.93 -1.22 118.70 125.68 3itv s GLU 219 Ca 0.10 -0.84 -0.12 0.00 0.36 0.00 0.00 54.97 54.47 3itv s GLU 219 Cb -0.12 -2.93 -0.06 0.00 0.26 0.00 0.00 34.13 31.28 3itv s GLU 219 CO 0.02 -0.30 0.92 -3.38 -0.54 0.00 0.00 175.26 171.98 3itv s HIS 220 N 1.37 3.51 -0.25 5.30 -3.43 -1.26 -4.71 115.29 115.83 3itv s HIS 220 Ca 0.03 1.24 -0.13 0.00 -0.80 0.00 0.00 55.06 55.40 3itv s HIS 220 Cb -0.15 -2.63 0.08 0.00 -1.43 0.00 0.00 32.58 28.45 3itv s HIS 220 CO -0.05 -0.37 0.60 0.21 -2.00 0.00 0.00 174.74 173.13 3itv s LYS 221 N -4.35 0.60 0.19 -0.38 2.20 0.05 -4.75 119.74 113.31 3itv s LYS 221 Ca 0.55 1.14 -0.12 0.00 -0.36 0.00 0.00 55.97 57.18 3itv s LYS 221 Cb -0.10 0.20 0.11 0.00 -1.51 0.00 0.00 37.83 36.52 3itv s LYS 221 CO 0.38 -0.16 1.85 1.98 -0.36 0.00 0.00 175.35 179.04 3itv h MET 222 N 7.21 0.84 -2.68 4.03 1.85 -1.19 -3.34 114.93 121.66 3itv h MET 222 Ca -0.29 -0.05 0.11 0.00 -0.61 0.00 0.00 59.70 58.85 3itv h MET 222 Cb 1.20 -0.19 -0.07 0.00 0.43 0.00 0.00 31.60 32.97 3itv h MET 222 CO 0.18 0.56 0.35 1.52 -0.40 0.00 0.00 176.91 179.13 3itv s TYR 223 N -6.12 -0.19 0.02 1.39 1.13 -1.26 -4.51 117.35 107.81 3itv s TYR 223 Ca -0.13 -0.17 0.00 0.00 -1.41 0.00 0.00 57.07 55.36 3itv s TYR 223 Cb 0.14 0.66 0.00 0.00 -1.10 0.00 0.00 41.96 41.66 3itv s TYR 223 CO 0.76 -1.00 0.00 -1.91 -2.51 0.00 0.00 175.55 170.89 3itv n GLU 224 N -0.45 -0.84 0.17 -3.49 2.13 -1.26 -4.82 120.64 112.08 3itv n GLU 224 Ca -0.06 1.02 0.13 0.00 0.66 0.00 0.00 57.16 58.92 3itv n GLU 224 Cb 0.60 -0.84 0.56 0.00 0.27 0.00 0.00 31.44 32.03 3itv n GLU 224 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 3itv h PRO 225 N 0.66 0.00 -6.10 5.31 0.13 -1.94 -3.49 132.00 126.58 3itv h PRO 225 Ca 0.00 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.57 3itv h PRO 225 Cb 0.00 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.08 3itv h PRO 225 CO 0.00 0.00 0.18 0.00 -0.23 0.00 0.00 178.00 177.95 3itv s ALA 226 N -3.43 3.32 -1.54 -0.56 0.00 -1.26 -4.97 121.76 113.32 3itv s ALA 226 Ca 0.03 0.20 0.17 0.00 0.00 0.00 0.00 51.96 52.36 3itv s ALA 226 Cb 0.09 -3.06 0.48 0.00 0.00 0.00 0.00 23.12 20.63 3itv s ALA 226 CO 0.42 -0.19 1.40 1.19 0.00 0.00 0.00 175.76 178.58 3itv n PHE 227 N 3.97 0.72 0.04 0.00 3.72 -1.22 -4.57 117.46 120.11 3itv n PHE 227 Ca 0.01 -0.48 0.00 0.00 -0.05 0.00 0.00 57.45 56.93 3itv n PHE 227 Cb 0.51 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.04 3itv n PHE 227 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 3itv n TYR 228 N 1.15 -0.33 -4.00 1.38 9.36 -0.36 -4.92 117.16 119.42 3itv n TYR 228 Ca 0.19 0.06 -0.09 0.00 3.32 0.00 0.00 57.90 61.38 3itv n TYR 228 Cb 0.53 0.15 -0.11 0.00 -0.63 0.00 0.00 39.34 39.29 3itv n TYR 228 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3itv s SER 229 N -5.33 0.30 -0.03 2.98 1.04 -0.50 -4.97 113.70 107.19 3itv s SER 229 Ca 0.00 -0.63 0.02 0.00 0.48 0.00 0.00 55.95 55.83 3itv s SER 229 Cb 0.00 0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.26 3itv s SER 229 CO 0.00 -0.39 -0.09 -0.89 0.98 0.00 0.00 173.24 172.85 3itv s THR 230 N -2.16 0.76 0.10 2.02 2.01 -1.26 -0.29 115.64 116.82 3itv s THR 230 Ca -0.09 -0.34 -0.28 0.00 0.31 0.00 0.00 61.69 61.28 3itv s THR 230 Cb -0.05 -0.69 -0.12 0.00 0.01 0.00 0.00 72.50 71.66 3itv s THR 230 CO -0.03 0.24 1.65 0.58 -0.69 0.00 0.00 174.62 176.37 3itv h VAL 231 N 5.44 0.47 -3.19 3.82 2.07 -1.61 -3.08 116.25 120.17 3itv h VAL 231 Ca -0.33 0.00 -0.80 0.00 0.82 0.00 0.00 66.70 66.39 3itv h VAL 231 Cb 1.17 0.47 -0.29 0.00 -1.52 0.00 0.00 31.29 31.13 3itv h VAL 231 CO 0.49 0.00 0.58 0.52 0.02 0.00 0.00 177.57 179.18 3itv n VAL 232 N -5.37 4.86 0.05 2.57 0.31 -1.26 -4.83 118.33 114.66 3itv n VAL 232 Ca -0.08 -5.66 -0.08 0.00 -0.01 0.00 0.00 64.34 58.51 3itv n VAL 232 Cb 0.28 -2.31 -0.12 0.00 -0.91 0.00 0.00 33.84 30.77 3itv n VAL 232 CO 0.00 0.00 0.00 0.06 -1.32 0.00 0.00 176.83 175.57 3itv h GLN 233 N 5.94 0.01 0.00 5.55 -0.00 -1.66 0.19 115.11 125.14 3itv h GLN 233 Ca 0.19 -0.02 -0.24 0.00 -0.00 0.00 0.00 58.65 58.58 3itv h GLN 233 Cb 0.73 0.01 -0.06 0.00 -0.00 0.00 0.00 27.48 28.16 3itv h GLN 233 CO 1.17 0.92 -0.08 -0.40 -0.00 0.00 0.00 178.83 180.44 3itv n ASP 234 N -3.30 -1.47 0.26 0.06 5.68 -1.26 -2.17 116.55 114.34 3itv n ASP 234 Ca -0.03 -2.82 0.12 0.00 -0.50 0.00 0.00 54.79 51.56 3itv n ASP 234 Cb 0.96 2.68 0.68 0.00 -1.14 0.00 0.00 41.12 44.30 3itv n ASP 234 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 3itv h TRP 235 N 1.99 0.00 -0.03 2.11 5.08 -1.95 -1.35 115.95 121.81 3itv h TRP 235 Ca -0.28 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.69 3itv h TRP 235 Cb 1.18 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.33 3itv h TRP 235 CO 0.00 0.14 0.00 0.78 -1.28 0.00 0.00 178.44 178.08 3itv h GLY 236 N 1.07 0.06 1.13 11.11 0.00 -1.99 0.16 103.07 114.61 3itv h GLY 236 Ca -0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 47.33 47.22 3itv h GLY 236 CO 0.02 0.04 0.14 -0.84 0.00 0.00 0.00 176.54 175.90 3itv h THR 237 N -0.24 1.26 -0.87 4.70 2.02 -1.90 -2.08 112.91 115.79 3itv h THR 237 Ca 0.01 -0.97 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 3itv h THR 237 Cb 0.32 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 3itv h THR 237 CO 0.00 0.37 0.53 -1.13 0.37 0.00 0.00 175.52 175.66 3itv h ASN 238 N 1.01 1.04 -0.42 4.18 -0.73 -1.04 -1.03 115.58 118.60 3itv h ASN 238 Ca 0.21 -0.07 -0.02 0.00 1.87 0.00 0.00 56.30 58.29 3itv h ASN 238 Cb 0.38 -0.26 -0.02 0.00 0.27 0.00 0.00 38.32 38.69 3itv h ASN 238 CO 0.00 0.80 0.18 0.22 -0.37 0.00 0.00 177.43 178.27 3itv h TYR 239 N 1.20 0.63 -0.97 0.67 3.20 -0.25 -1.42 116.97 120.03 3itv h TYR 239 Ca 0.31 -0.04 0.07 0.00 3.14 0.00 0.00 58.73 62.21 3itv h TYR 239 Cb -0.05 -0.19 -0.07 0.00 1.54 0.00 0.00 36.73 37.96 3itv h TYR 239 CO -0.00 0.54 0.62 -0.07 -1.64 0.00 0.00 178.16 177.60 3itv h LEU 240 N 0.54 0.98 0.59 2.82 3.38 -0.81 0.43 115.31 123.25 3itv h LEU 240 Ca 0.14 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 3itv h LEU 240 Cb 0.16 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.73 3itv h LEU 240 CO -0.01 0.61 -0.29 0.40 0.09 0.00 0.00 178.44 179.24 3itv h ILE 241 N 1.11 0.39 -0.63 1.22 2.04 -0.69 -1.37 117.51 119.58 3itv h ILE 241 Ca 0.43 -0.12 0.03 0.00 1.00 0.00 0.00 64.86 66.19 3itv h ILE 241 Cb 0.20 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 3itv h ILE 241 CO -0.18 0.02 0.39 0.00 0.00 0.00 0.00 178.15 178.37 3itv h ALA 242 N -0.51 0.82 -0.66 1.87 0.00 -0.91 -0.46 119.26 119.40 3itv h ALA 242 Ca -0.08 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 3itv h ALA 242 Cb 0.64 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3itv h ALA 242 CO 0.13 0.14 0.15 0.37 0.00 0.00 0.00 179.25 180.04 3itv h GLN 243 N 0.76 1.06 -0.25 0.00 5.75 -0.92 -2.82 115.11 118.69 3itv h GLN 243 Ca 0.25 -0.25 -0.08 0.00 -0.15 0.00 0.00 58.65 58.42 3itv h GLN 243 Cb 0.02 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.43 3itv h GLN 243 CO -0.10 0.94 -0.16 1.15 -2.65 0.00 0.00 178.83 178.01 3itv h THR 244 N 1.00 1.31 -0.32 2.39 2.02 -0.73 -3.33 112.91 115.24 3itv h THR 244 Ca 0.21 -1.27 -0.08 0.00 0.77 0.00 0.00 66.41 66.05 3itv h THR 244 Cb 0.37 1.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 3itv h THR 244 CO 0.00 0.39 -0.10 -0.07 0.37 0.00 0.00 175.52 176.12 3itv h LEU 245 N 0.26 0.64 0.00 2.58 3.38 -1.05 -3.50 115.31 117.62 3itv h LEU 245 Ca 0.05 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3itv h LEU 245 Cb 0.68 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3itv h LEU 245 CO 0.04 0.87 0.00 0.61 0.09 0.00 0.00 178.44 180.05 3itv n GLY 246 N -0.13 1.95 0.34 0.83 0.00 -1.07 -4.92 105.19 102.19 3itv n GLY 246 Ca -0.03 -1.76 0.17 0.00 0.00 0.00 0.00 46.02 44.40 3itv n GLY 246 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3itv h PRO 247 N 0.00 0.00 -0.00 1.61 0.13 -1.91 -1.23 132.00 130.61 3itv h PRO 247 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3itv h PRO 247 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3itv h PRO 247 CO 0.00 0.00 -0.10 1.63 -0.23 0.00 0.00 178.00 179.30 3itv n LYS 248 N -3.79 0.18 -3.74 0.86 5.02 -1.26 -4.78 118.16 110.65 3itv n LYS 248 Ca 0.02 -0.03 -0.36 0.00 -2.02 0.00 0.00 58.31 55.92 3itv n LYS 248 Cb 0.36 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.78 3itv n LYS 248 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3itv s ALA 249 N -2.84 3.57 0.25 7.82 0.00 -0.46 -0.37 121.76 129.73 3itv s ALA 249 Ca 0.18 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.33 3itv s ALA 249 Cb 0.19 -2.21 -0.05 0.00 0.00 0.00 0.00 23.12 21.06 3itv s ALA 249 CO 0.54 -0.06 0.11 -0.65 0.00 0.00 0.00 175.76 175.70 3itv s GLN 250 N 0.79 1.37 -0.12 0.00 -0.21 -0.12 -4.72 119.66 116.66 3itv s GLN 250 Ca 0.07 -1.74 -0.10 0.00 0.02 0.00 0.00 55.36 53.61 3itv s GLN 250 Cb -0.13 -0.11 -0.05 0.00 1.00 0.00 0.00 33.01 33.73 3itv s GLN 250 CO 0.02 -0.33 0.20 0.00 -2.12 0.00 0.00 175.29 173.06 3itv s LEU 252 N -0.58 3.57 -0.34 0.00 0.20 -0.35 0.31 118.68 121.49 3itv s LEU 252 Ca 0.15 -0.00 -0.09 0.00 0.69 0.00 0.00 54.13 54.87 3itv s LEU 252 Cb -0.13 -1.88 0.02 0.00 -0.43 0.00 0.00 46.19 43.77 3itv s LEU 252 CO 0.04 0.18 0.16 -0.69 -0.29 0.00 0.00 176.35 175.75 3itv s VAL 253 N 0.33 4.37 -0.32 1.68 1.01 -0.62 -4.00 120.40 122.86 3itv s VAL 253 Ca 0.00 -0.77 -0.12 0.00 0.00 0.00 0.00 61.98 61.09 3itv s VAL 253 Cb -0.13 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 3itv s VAL 253 CO 0.01 -0.10 0.23 -0.62 0.00 0.00 0.00 175.10 174.62 3itv s ASP 254 N 1.54 6.05 0.29 3.32 -1.08 -1.26 -1.52 116.67 124.01 3itv s ASP 254 Ca 0.02 -0.25 0.03 0.00 -0.52 0.00 0.00 52.55 51.83 3itv s ASP 254 Cb -0.18 -2.13 0.73 0.00 -1.46 0.00 0.00 42.92 39.87 3itv s ASP 254 CO 0.05 -0.17 1.66 -0.07 0.52 0.00 0.00 175.17 177.17 3itv h LEU 255 N 8.46 0.13 -0.98 -1.34 3.38 -1.78 -1.47 115.31 121.71 3itv h LEU 255 Ca -0.33 0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3itv h LEU 255 Cb 1.17 0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.14 3itv h LEU 255 CO 0.60 -0.11 0.00 0.61 0.09 0.00 0.00 178.44 179.64 3itv n GLY 256 N -1.36 0.52 1.88 0.83 0.00 -1.26 -4.12 105.19 101.68 3itv n GLY 256 Ca 0.22 -0.20 -0.04 0.00 0.00 0.00 0.00 46.02 46.00 3itv n GLY 256 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3itv n HIS 257 N 0.07 2.27 -4.42 1.61 8.25 -0.55 -3.53 115.22 118.91 3itv n HIS 257 Ca 0.06 -1.17 -0.24 0.00 -0.26 0.00 0.00 57.72 56.12 3itv n HIS 257 Cb 0.26 -0.64 -0.09 0.00 1.12 0.00 0.00 29.99 30.64 3itv n HIS 257 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3itv s HIS 258 N -2.98 2.41 0.75 4.41 3.76 -1.26 -2.63 115.29 119.75 3itv s HIS 258 Ca 0.54 -0.30 -0.14 0.00 -0.15 0.00 0.00 55.06 55.00 3itv s HIS 258 Cb 0.43 -1.06 0.05 0.00 1.11 0.00 0.00 32.58 33.11 3itv s HIS 258 CO 0.13 0.67 1.20 0.00 -0.85 0.00 0.00 174.74 175.89 3itv s ALA 259 N -2.38 2.05 0.28 -1.40 0.00 -1.26 -4.89 121.76 114.16 3itv s ALA 259 Ca 0.30 0.85 -0.29 0.00 0.00 0.00 0.00 51.96 52.81 3itv s ALA 259 Cb -0.06 -3.47 -0.13 0.00 0.00 0.00 0.00 23.12 19.46 3itv s ALA 259 CO 0.16 -1.98 1.26 -2.30 0.00 0.00 0.00 175.76 172.89 3itv n PRO 260 N -2.89 1.85 -0.90 0.00 -0.02 -1.26 -2.12 135.00 129.66 3itv n PRO 260 Ca 0.13 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 3itv n PRO 260 Cb 0.50 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 3itv n PRO 260 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3itv n ASN 261 N 1.41 -2.67 -4.72 2.55 3.02 -1.26 -4.99 115.26 108.60 3itv n ASN 261 Ca 0.09 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.23 3itv n ASN 261 Cb 0.33 -1.70 0.01 0.00 -0.61 0.00 0.00 39.78 37.81 3itv n ASN 261 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3itv n THR 262 N -2.30 2.52 -2.90 3.41 -1.04 -0.90 -4.90 114.28 108.18 3itv n THR 262 Ca 0.00 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.05 61.08 3itv n THR 262 Cb 0.15 -1.67 -0.03 0.00 -1.82 0.00 0.00 70.33 66.95 3itv n THR 262 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3itv s ASN 263 N -0.46 6.39 0.14 8.00 3.84 -1.26 -4.86 114.94 126.73 3itv s ASN 263 Ca 0.60 -1.52 -0.10 0.00 0.21 0.00 0.00 52.86 52.05 3itv s ASN 263 Cb -0.50 -2.41 -0.04 0.00 -0.55 0.00 0.00 41.25 37.76 3itv s ASN 263 CO 0.59 -1.25 1.45 0.40 -2.79 0.00 0.00 177.10 175.50 3itv h ILE 264 N 5.93 1.28 0.00 -5.21 2.04 -1.98 -3.03 117.51 116.53 3itv h ILE 264 Ca -0.07 -1.66 -0.00 0.00 1.00 0.00 0.00 64.86 64.13 3itv h ILE 264 Cb 1.05 1.53 -0.00 0.00 -0.74 0.00 0.00 36.82 38.66 3itv h ILE 264 CO 1.15 0.54 -0.02 1.05 0.00 0.00 0.00 178.15 180.87 3itv h GLU 265 N 0.68 0.00 -0.37 2.37 9.09 -1.90 -1.23 114.58 123.22 3itv h GLU 265 Ca 0.03 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.29 3itv h GLU 265 Cb 1.07 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.16 3itv h GLU 265 CO 0.11 0.02 -0.37 1.98 0.05 0.00 0.00 179.01 180.80 3itv h MET 266 N 0.00 0.88 -0.79 1.06 4.05 -1.93 -2.07 114.93 116.13 3itv h MET 266 Ca -0.00 -0.45 0.01 0.00 -0.28 0.00 0.00 59.70 58.98 3itv h MET 266 Cb 0.04 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.81 3itv h MET 266 CO 0.00 1.10 0.52 0.82 0.23 0.00 0.00 176.91 179.58 3itv h ILE 267 N 0.72 1.19 -0.38 1.77 2.04 -1.23 -0.13 117.51 121.50 3itv h ILE 267 Ca 0.06 -0.36 0.02 0.00 1.00 0.00 0.00 64.86 65.58 3itv h ILE 267 Cb 0.95 0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 3itv h ILE 267 CO 0.09 0.19 0.21 0.58 0.00 0.00 0.00 178.15 179.23 3itv h VAL 268 N 1.06 1.03 -0.50 1.67 2.07 -1.16 -1.22 116.25 119.19 3itv h VAL 268 Ca 0.30 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.66 3itv h VAL 268 Cb -0.10 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 3itv h VAL 268 CO -0.07 0.08 0.30 0.00 0.02 0.00 0.00 177.57 177.90 3itv h ALA 269 N 1.17 0.64 -0.45 1.67 0.00 -0.67 -1.55 119.26 120.07 3itv h ALA 269 Ca 0.15 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3itv h ALA 269 Cb 0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3itv h ALA 269 CO -0.08 0.13 0.26 0.00 0.00 0.00 0.00 179.25 179.56 3itv h ARG 270 N 0.67 0.63 -0.53 0.00 2.47 -0.72 -0.28 114.38 116.63 3itv h ARG 270 Ca 0.18 -0.07 -0.06 0.00 -1.26 0.00 0.00 59.98 58.77 3itv h ARG 270 Cb -0.00 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.17 3itv h ARG 270 CO -0.03 0.49 0.09 -0.07 0.56 0.00 0.00 179.97 181.00 3itv h LEU 271 N 0.60 0.79 -0.30 3.04 3.38 -1.04 -2.31 115.31 119.46 3itv h LEU 271 Ca 0.16 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3itv h LEU 271 Cb 0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 3itv h LEU 271 CO -0.03 0.80 0.05 0.40 0.09 0.00 0.00 178.44 179.75 3itv h ILE 272 N 0.80 1.23 -0.91 1.22 2.04 -0.89 0.14 117.51 121.14 3itv h ILE 272 Ca 0.17 -0.80 0.13 0.00 1.00 0.00 0.00 64.86 65.37 3itv h ILE 272 Cb 0.35 1.18 -0.07 0.00 -0.74 0.00 0.00 36.82 37.54 3itv h ILE 272 CO 0.01 0.26 0.58 -0.61 0.00 0.00 0.00 178.15 178.39 3itv h GLN 273 N 0.32 0.74 -0.60 2.37 4.15 -0.68 -1.48 115.11 119.93 3itv h GLN 273 Ca 0.09 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.47 3itv h GLN 273 Cb 0.34 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.86 3itv h GLN 273 CO 0.01 0.49 0.00 1.19 -1.93 0.00 0.00 178.83 178.58 3itv n PHE 274 N -4.57 1.61 -2.54 3.99 3.72 -0.90 -4.96 117.46 113.81 3itv n PHE 274 Ca 0.17 -0.66 -0.21 0.00 -0.05 0.00 0.00 57.45 56.70 3itv n PHE 274 Cb 0.43 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 3itv n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3itv n GLY 275 N 0.86 -0.50 0.13 1.37 0.00 -0.56 -4.91 105.19 101.58 3itv n GLY 275 Ca 0.26 0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.40 3itv n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3itv n LYS 276 N -3.25 1.20 -2.81 1.61 4.76 0.40 -4.94 118.16 115.14 3itv n LYS 276 Ca -0.22 -2.51 -0.43 0.00 -2.87 0.00 0.00 58.31 52.28 3itv n LYS 276 Cb 0.67 -1.43 -0.03 0.00 -1.84 0.00 0.00 35.03 32.40 3itv n LYS 276 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3itv s LEU 277 N -2.69 4.28 0.08 -0.35 2.96 -1.18 -0.53 118.68 121.25 3itv s LEU 277 Ca 0.30 -1.14 -0.15 0.00 -0.22 0.00 0.00 54.13 52.92 3itv s LEU 277 Cb 0.27 -2.44 -0.15 0.00 0.50 0.00 0.00 46.19 44.36 3itv s LEU 277 CO 0.02 -1.43 1.30 1.23 -1.32 0.00 0.00 176.35 176.15 3itv h GLY 278 N 11.51 0.76 0.00 7.98 0.00 -0.43 -3.42 103.07 119.47 3itv h GLY 278 Ca -0.17 -1.01 0.00 0.00 0.00 0.00 0.00 47.33 46.15 3itv h GLY 278 CO 1.20 0.90 0.00 0.61 0.00 0.00 0.00 176.54 179.25 3itv n GLY 279 N 0.61 -1.16 3.33 4.60 0.00 -1.15 -1.09 105.19 110.32 3itv n GLY 279 Ca -0.07 -0.94 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 3itv n GLY 279 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3itv s PHE 280 N -3.00 1.58 -0.35 1.61 0.08 -0.42 -1.58 117.98 115.90 3itv s PHE 280 Ca 0.00 -0.72 0.00 0.00 0.12 0.00 0.00 56.93 56.33 3itv s PHE 280 Cb 0.00 -0.82 0.11 0.00 -0.57 0.00 0.00 43.02 41.74 3itv s PHE 280 CO 0.00 0.18 0.14 -1.01 -0.10 0.00 0.00 175.22 174.43 3itv s HIS 281 N -3.18 1.86 0.27 0.36 3.76 -0.58 -2.00 115.29 115.79 3itv s HIS 281 Ca 0.23 -2.01 -0.29 0.00 -0.15 0.00 0.00 55.06 52.84 3itv s HIS 281 Cb 0.02 -1.80 -0.09 0.00 1.11 0.00 0.00 32.58 31.82 3itv s HIS 281 CO 0.06 -0.85 0.94 -0.06 -0.85 0.00 0.00 174.74 173.98 3itv s PHE 282 N 1.16 3.87 0.00 1.40 0.40 0.14 -2.31 117.98 122.64 3itv s PHE 282 Ca 0.13 1.87 0.00 0.00 -0.60 0.00 0.00 56.93 58.32 3itv s PHE 282 Cb -0.20 -2.97 0.00 0.00 0.51 0.00 0.00 43.02 40.37 3itv s PHE 282 CO -0.15 0.35 0.00 0.27 0.70 0.00 0.00 175.22 176.39 3itv n ASN 283 N 1.14 0.00 -4.37 1.36 0.23 -1.26 -1.17 115.26 111.20 3itv n ASN 283 Ca -0.01 0.00 -0.18 0.00 -0.53 0.00 0.00 54.58 53.86 3itv n ASN 283 Cb 0.48 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.08 3itv n ASN 283 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3itv s ASP 284 N 0.00 1.92 0.10 0.53 -1.08 0.50 -4.58 116.67 114.06 3itv s ASP 284 Ca 0.00 -1.29 -0.26 0.00 -0.52 0.00 0.00 52.55 50.48 3itv s ASP 284 Cb 0.00 -0.00 0.08 0.00 -1.46 0.00 0.00 42.92 41.54 3itv s ASP 284 CO 0.00 -0.56 0.85 -0.94 0.52 0.00 0.00 175.17 175.04 3itv s SER 285 N -3.36 -0.33 0.00 -0.34 1.04 -1.26 -1.23 113.70 108.22 3itv s SER 285 Ca 0.32 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.57 3itv s SER 285 Cb 0.07 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.67 3itv s SER 285 CO 0.12 -0.83 0.00 1.17 0.98 0.00 0.00 173.24 174.67 3itv n LYS 286 N -0.36 2.06 0.01 4.02 4.81 -1.26 -4.75 118.16 122.69 3itv n LYS 286 Ca -0.09 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.33 3itv n LYS 286 Cb 0.62 -0.76 -0.01 0.00 0.02 0.00 0.00 35.03 34.90 3itv n LYS 286 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3itv n TYR 287 N -1.26 0.00 0.00 5.64 4.01 -1.26 -5.10 117.16 119.19 3itv n TYR 287 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3itv n TYR 287 Cb 0.25 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 3itv n TYR 287 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3itv n GLY 288 N 2.99 5.21 2.81 2.72 0.00 -1.26 -4.91 105.19 112.75 3itv n GLY 288 Ca -0.04 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 3itv n GLY 288 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3itv n ASP 289 N 0.00 4.91 0.27 1.61 2.03 -1.23 -4.73 116.55 119.41 3itv n ASP 289 Ca 0.00 -3.04 0.15 0.00 0.52 0.00 0.00 54.79 52.42 3itv n ASP 289 Cb 0.00 -1.52 0.71 0.00 -0.72 0.00 0.00 41.12 39.59 3itv n ASP 289 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 3itv h ASP 290 N 5.76 0.00 -5.49 1.67 3.32 -1.83 -3.47 116.42 116.38 3itv h ASP 290 Ca 0.45 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 57.08 3itv h ASP 290 Cb 0.62 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 3itv h ASP 290 CO 1.69 0.08 -0.64 0.47 -1.72 0.00 0.00 179.24 179.12 3itv n ASP 291 N -3.28 -4.87 -4.90 6.45 8.00 -1.23 -4.83 116.55 111.90 3itv n ASP 291 Ca -0.00 -0.50 -0.28 0.00 0.71 0.00 0.00 54.79 54.72 3itv n ASP 291 Cb 0.29 -3.94 0.05 0.00 -0.02 0.00 0.00 41.12 37.51 3itv n ASP 291 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3itv s LEU 292 N -6.85 2.90 0.14 0.64 1.43 -0.36 -1.80 118.68 114.78 3itv s LEU 292 Ca 0.47 0.87 -0.35 0.00 -1.03 0.00 0.00 54.13 54.10 3itv s LEU 292 Cb -0.23 -3.60 -0.15 0.00 0.03 0.00 0.00 46.19 42.24 3itv s LEU 292 CO 0.58 -1.41 1.49 0.47 0.23 0.00 0.00 176.35 177.71 3itv n ASP 293 N -2.95 2.58 -4.63 2.29 9.92 -1.26 -0.37 116.55 122.13 3itv n ASP 293 Ca 0.07 1.10 -0.47 0.00 -0.53 0.00 0.00 54.79 54.95 3itv n ASP 293 Cb 0.58 -1.35 -0.04 0.00 -0.64 0.00 0.00 41.12 39.68 3itv n ASP 293 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3itv n ALA 294 N 3.05 0.26 -0.69 2.24 0.00 -1.26 -1.76 120.51 122.36 3itv n ALA 294 Ca 0.17 0.44 0.00 0.00 0.00 0.00 0.00 53.44 54.06 3itv n ALA 294 Cb 0.26 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.53 3itv n ALA 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3itv n GLY 295 N 2.26 0.83 0.24 0.00 0.00 -1.26 -4.75 105.19 102.50 3itv n GLY 295 Ca 0.14 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.31 3itv n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3itv h ALA 296 N 0.00 1.00 0.00 4.61 0.00 -1.71 -3.27 119.26 119.89 3itv h ALA 296 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 3itv h ALA 296 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3itv h ALA 296 CO 0.00 0.00 -1.58 -0.89 0.00 0.00 0.00 179.25 176.78 3itv n ILE 297 N -2.99 0.67 -3.60 0.00 5.41 -1.26 -4.91 119.36 112.67 3itv n ILE 297 Ca 0.02 -0.14 -0.27 0.00 1.00 0.00 0.00 62.75 63.36 3itv n ILE 297 Cb 0.37 -1.67 -0.11 0.00 -0.71 0.00 0.00 39.64 37.53 3itv n ILE 297 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3itv n GLU 298 N -3.53 0.94 0.23 0.38 1.02 -1.26 -4.97 120.64 113.44 3itv n GLU 298 Ca -0.22 -3.76 0.05 0.00 -0.02 0.00 0.00 57.16 53.22 3itv n GLU 298 Cb 0.64 -1.93 0.51 0.00 -0.02 0.00 0.00 31.44 30.64 3itv n GLU 298 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3itv h PRO 299 N 5.45 0.00 -0.29 3.49 0.13 -1.91 -2.86 132.00 136.02 3itv h PRO 299 Ca 0.21 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.19 3itv h PRO 299 Cb 0.84 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 3itv h PRO 299 CO 0.53 0.17 -0.42 -0.92 -0.23 0.00 0.00 178.00 177.13 3itv h TYR 300 N 0.00 0.85 -0.94 1.56 3.20 -1.93 -2.26 116.97 117.46 3itv h TYR 300 Ca -0.00 -0.26 -0.00 0.00 3.14 0.00 0.00 58.73 61.60 3itv h TYR 300 Cb 0.30 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.35 3itv h TYR 300 CO 0.00 1.01 0.57 -0.09 -1.64 0.00 0.00 178.16 178.01 3itv h ARG 301 N 0.58 1.27 -0.70 1.82 2.43 -1.94 0.75 114.38 118.58 3itv h ARG 301 Ca 0.04 -0.11 -0.06 0.00 -0.81 0.00 0.00 59.98 59.05 3itv h ARG 301 Cb 0.97 -0.27 -0.03 0.00 -0.42 0.00 0.00 29.97 30.22 3itv h ARG 301 CO 0.09 0.88 0.22 1.25 -1.51 0.00 0.00 179.97 180.90 3itv h LEU 302 N 1.29 1.02 -0.64 3.80 5.85 -1.42 -1.46 115.31 123.75 3itv h LEU 302 Ca 0.34 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 3itv h LEU 302 Cb -0.07 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.67 3itv h LEU 302 CO -0.06 0.96 0.21 0.15 -0.34 0.00 0.00 178.44 179.36 3itv h PHE 303 N 1.03 1.02 -0.18 1.25 3.57 -0.74 -1.92 116.94 120.96 3itv h PHE 303 Ca 0.23 -0.10 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 3itv h PHE 303 Cb 0.30 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 3itv h PHE 303 CO 0.02 0.83 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.73 3itv h LEU 304 N 0.92 0.28 -0.24 0.59 3.38 -0.43 0.26 115.31 120.06 3itv h LEU 304 Ca 0.21 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 3itv h LEU 304 Cb 0.27 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3itv h LEU 304 CO -0.01 0.44 -0.10 0.58 0.09 0.00 0.00 178.44 179.44 3itv h VAL 305 N 0.28 1.30 0.00 1.22 2.07 -0.97 -2.76 116.25 117.39 3itv h VAL 305 Ca 0.06 -1.15 -0.04 0.00 0.82 0.00 0.00 66.70 66.38 3itv h VAL 305 Cb 0.40 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 3itv h VAL 305 CO 0.02 0.36 -0.20 -0.26 0.02 0.00 0.00 177.57 177.51 3itv h PHE 306 N 0.22 0.00 -0.59 1.57 0.04 -0.69 -1.98 116.94 115.52 3itv h PHE 306 Ca 0.06 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.77 3itv h PHE 306 Cb 0.59 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.71 3itv h PHE 306 CO 0.06 0.20 0.13 -0.97 -0.60 0.00 0.00 178.31 177.13 3itv h ASN 307 N 0.00 0.86 -0.16 2.17 -1.24 -0.23 0.13 115.58 117.11 3itv h ASN 307 Ca -0.00 -0.17 -0.17 0.00 0.71 0.00 0.00 56.30 56.67 3itv h ASN 307 Cb 0.54 -0.23 -0.00 0.00 0.73 0.00 0.00 38.32 39.36 3itv h ASN 307 CO 0.03 0.85 -0.52 -0.33 -1.29 0.00 0.00 177.43 176.16 3itv h GLU 308 N 0.88 0.74 -0.30 6.67 4.39 -1.17 -1.73 114.58 124.06 3itv h GLU 308 Ca 0.19 -0.45 -0.04 0.00 0.34 0.00 0.00 59.36 59.40 3itv h GLU 308 Cb 0.33 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 3itv h GLU 308 CO 0.00 1.08 0.04 -0.07 -1.16 0.00 0.00 179.01 178.90 3itv h LEU 309 N 0.58 0.48 -0.89 1.33 3.38 -0.90 -2.42 115.31 116.86 3itv h LEU 309 Ca 0.02 -0.26 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 3itv h LEU 309 Cb 1.10 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 3itv h LEU 309 CO 0.11 0.62 -0.39 0.58 0.09 0.00 0.00 178.44 179.45 3itv h VAL 310 N 0.31 1.30 -0.42 1.22 2.07 -0.78 0.11 116.25 120.07 3itv h VAL 310 Ca 0.09 -1.50 0.00 0.00 0.82 0.00 0.00 66.70 66.12 3itv h VAL 310 Cb 0.35 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 3itv h VAL 310 CO 0.01 0.46 0.27 -0.78 0.02 0.00 0.00 177.57 177.54 3itv h ASP 311 N 0.28 0.49 -0.49 0.57 3.58 -1.19 0.97 116.42 120.63 3itv h ASP 311 Ca 0.03 -0.02 -0.10 0.00 0.42 0.00 0.00 57.03 57.35 3itv h ASP 311 Cb 0.81 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.72 3itv h ASP 311 CO 0.06 0.37 -0.07 0.00 -2.88 0.00 0.00 179.24 176.72 3itv h ALA 312 N 1.14 0.88 0.00 -0.78 0.00 -1.10 -1.60 119.26 117.80 3itv h ALA 312 Ca 0.15 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3itv h ALA 312 Cb -0.05 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 3itv h ALA 312 CO -0.03 0.65 -0.10 1.49 0.00 0.00 0.00 179.25 181.25 3itv h GLU 313 N 0.86 0.00 0.10 0.00 4.81 0.03 -1.96 114.58 118.42 3itv h GLU 313 Ca 0.15 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 3itv h GLU 313 Cb 0.60 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.98 3itv h GLU 313 CO 0.04 0.10 -0.05 0.00 -0.73 0.00 0.00 179.01 178.37 3itv h ALA 314 N 1.90 -0.18 0.00 2.92 0.00 0.17 -3.21 119.26 120.85 3itv h ALA 314 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3itv h ALA 314 Cb 0.57 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3itv h ALA 314 CO 0.01 -0.18 0.00 2.89 0.00 0.00 0.00 179.25 181.98 3itv n ARG 315 N -3.86 0.41 -3.86 0.00 0.00 -0.67 -4.83 116.66 103.84 3itv n ARG 315 Ca -0.02 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.51 3itv n ARG 315 Cb 0.05 -1.20 0.01 0.00 -0.00 0.00 0.00 32.46 31.32 3itv n ARG 315 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3itv n GLY 316 N 0.28 -1.01 3.56 2.89 0.00 -1.09 -4.79 105.19 105.03 3itv n GLY 316 Ca 0.00 0.44 -0.28 0.00 0.00 0.00 0.00 46.02 46.18 3itv n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3itv s VAL 317 N -3.24 3.46 0.46 1.61 1.01 -0.76 -4.91 120.40 118.04 3itv s VAL 317 Ca 0.20 -0.34 -0.21 0.00 0.00 0.00 0.00 61.98 61.63 3itv s VAL 317 Cb -0.11 -4.05 -0.11 0.00 0.00 0.00 0.00 36.38 32.11 3itv s VAL 317 CO 0.86 -0.99 0.59 2.29 0.00 0.00 0.00 175.10 177.85 3itv n LYS 318 N 8.88 0.65 0.00 2.72 2.85 -1.26 -1.55 118.16 130.45 3itv n LYS 318 Ca 0.38 0.24 0.00 0.00 -1.05 0.00 0.00 58.31 57.88 3itv n LYS 318 Cb 0.47 -1.63 0.00 0.00 -0.65 0.00 0.00 35.03 33.23 3itv n LYS 318 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3itv n GLY 319 N 1.71 2.46 3.56 2.58 0.00 -1.26 -4.93 105.19 109.32 3itv n GLY 319 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 3itv n GLY 319 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3itv n PHE 320 N -0.85 1.56 -3.19 1.61 -0.00 -0.60 -4.85 117.46 111.15 3itv n PHE 320 Ca 0.00 0.06 -0.23 0.00 -0.00 0.00 0.00 57.45 57.28 3itv n PHE 320 Cb 0.00 -2.66 -0.07 0.00 -0.00 0.00 0.00 39.48 36.75 3itv n PHE 320 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 3itv n HIS 321 N 14.70 -0.68 -1.75 -5.13 8.25 -1.26 -4.98 115.22 124.36 3itv n HIS 321 Ca 0.36 -3.38 -0.40 0.00 -0.26 0.00 0.00 57.72 54.04 3itv n HIS 321 Cb 0.51 -0.11 0.02 0.00 1.12 0.00 0.00 29.99 31.53 3itv n HIS 321 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3itv n PRO 322 N 1.69 2.08 -2.86 -0.41 -0.04 -1.26 -4.93 135.00 129.27 3itv n PRO 322 Ca 0.22 0.75 -0.43 0.00 -0.04 0.00 0.00 63.50 64.00 3itv n PRO 322 Cb 0.53 -2.60 -0.04 0.00 -0.04 0.00 0.00 33.50 31.34 3itv n PRO 322 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3itv s ALA 323 N -1.22 3.21 0.02 0.55 0.00 -0.25 -4.90 121.76 119.17 3itv s ALA 323 Ca 0.64 -1.08 -0.25 0.00 0.00 0.00 0.00 51.96 51.27 3itv s ALA 323 Cb -0.44 -3.65 -0.05 0.00 0.00 0.00 0.00 23.12 18.97 3itv s ALA 323 CO 0.55 -2.20 0.75 -1.01 0.00 0.00 0.00 175.76 173.85 3itv s HIS 324 N 3.75 3.70 -0.02 0.00 3.76 -1.26 -1.30 115.29 123.92 3itv s HIS 324 Ca 0.32 1.43 -0.13 0.00 -0.15 0.00 0.00 55.06 56.53 3itv s HIS 324 Cb -0.12 -2.81 0.02 0.00 1.11 0.00 0.00 32.58 30.78 3itv s HIS 324 CO 0.22 0.24 0.27 -1.64 -0.85 0.00 0.00 174.74 172.97 3itv s MET 325 N 0.11 0.60 -0.18 1.40 -1.94 -0.85 -1.14 119.30 117.31 3itv s MET 325 Ca 0.38 -0.19 -0.13 0.00 -1.71 0.00 0.00 55.69 54.04 3itv s MET 325 Cb -0.20 0.26 -0.05 0.00 2.01 0.00 0.00 34.83 36.86 3itv s MET 325 CO 0.22 -0.16 0.25 0.42 -0.01 0.00 0.00 175.02 175.75 3itv s ILE 326 N -1.22 5.33 -0.40 2.53 1.01 0.07 0.24 121.20 128.75 3itv s ILE 326 Ca -0.13 0.46 0.02 0.00 0.00 0.00 0.00 60.65 60.99 3itv s ILE 326 Cb -0.06 -3.59 0.12 0.00 0.01 0.00 0.00 42.46 38.94 3itv s ILE 326 CO 0.03 0.39 0.19 -0.62 0.00 0.00 0.00 174.94 174.93 3itv s ASP 327 N 0.52 3.88 0.16 3.58 -1.08 -0.32 -3.74 116.67 119.67 3itv s ASP 327 Ca 0.14 -2.36 0.01 0.00 -0.52 0.00 0.00 52.55 49.82 3itv s ASP 327 Cb -0.13 -1.08 -0.04 0.00 -1.46 0.00 0.00 42.92 40.21 3itv s ASP 327 CO 0.03 -0.31 0.02 -1.10 0.52 0.00 0.00 175.17 174.32 3itv s GLN 328 N 0.68 1.05 -0.03 4.34 -0.21 -1.26 -4.52 119.66 119.70 3itv s GLN 328 Ca 0.15 -1.50 0.03 0.00 0.02 0.00 0.00 55.36 54.06 3itv s GLN 328 Cb -0.22 -0.10 0.00 0.00 1.00 0.00 0.00 33.01 33.69 3itv s GLN 328 CO -0.07 -0.17 -0.12 0.15 -2.12 0.00 0.00 175.29 172.96 3itv s LYS 329 N -3.96 1.28 -0.36 2.91 -0.14 -0.75 -4.56 119.74 114.17 3itv s LYS 329 Ca 0.24 -0.41 -0.00 0.00 -1.36 0.00 0.00 55.97 54.43 3itv s LYS 329 Cb 0.07 -1.15 0.10 0.00 -1.68 0.00 0.00 37.83 35.16 3itv s LYS 329 CO 0.03 0.15 0.11 -1.01 -0.76 0.00 0.00 175.35 173.88 3itv s HIS 330 N 0.17 3.59 -0.15 3.18 3.76 -1.26 -4.61 115.29 119.97 3itv s HIS 330 Ca -0.04 -2.53 0.20 0.00 -0.15 0.00 0.00 55.06 52.54 3itv s HIS 330 Cb -0.10 -2.91 -0.14 0.00 1.11 0.00 0.00 32.58 30.54 3itv s HIS 330 CO 0.01 -0.94 0.76 0.09 -0.85 0.00 0.00 174.74 173.82 3itv n ASN 331 N 4.48 0.63 -0.46 1.40 3.02 -1.26 -0.90 115.26 122.16 3itv n ASN 331 Ca -0.02 0.26 0.04 0.00 -0.03 0.00 0.00 54.58 54.83 3itv n ASN 331 Cb 0.42 0.65 0.06 0.00 -0.61 0.00 0.00 39.78 40.30 3itv n ASN 331 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3itv n VAL 332 N -2.70 0.75 -4.17 2.41 0.24 -1.26 -4.76 118.33 108.84 3itv n VAL 332 Ca -0.08 -1.03 -0.12 0.00 -2.04 0.00 0.00 64.34 61.07 3itv n VAL 332 Cb 0.73 0.26 -0.09 0.00 -1.47 0.00 0.00 33.84 33.27 3itv n VAL 332 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3itv s THR 333 N -1.14 0.00 -0.22 3.34 -4.23 -1.26 -5.10 115.64 107.03 3itv s THR 333 Ca 0.16 -1.89 -0.29 0.00 -1.18 0.00 0.00 61.69 58.49 3itv s THR 333 Cb 0.15 -2.46 -0.01 0.00 1.34 0.00 0.00 72.50 71.52 3itv s THR 333 CO -0.01 0.00 1.38 -0.62 -0.54 0.00 0.00 174.62 174.83 3itv s ASP 334 N -3.15 6.71 0.31 3.99 -1.08 -1.26 -4.89 116.67 117.29 3itv s ASP 334 Ca 0.36 1.54 0.08 0.00 -0.52 0.00 0.00 52.55 54.00 3itv s ASP 334 Cb 0.05 -2.54 0.81 0.00 -1.46 0.00 0.00 42.92 39.79 3itv s ASP 334 CO 0.13 -1.00 1.74 -0.65 0.52 0.00 0.00 175.17 175.92 3itv h PRO 335 N 9.23 0.61 -0.59 4.34 0.11 -1.87 -1.02 132.00 142.82 3itv h PRO 335 Ca -0.29 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 3itv h PRO 335 Cb 1.12 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 3itv h PRO 335 CO 1.00 0.40 0.15 0.82 -0.21 0.00 0.00 178.00 180.17 3itv h ILE 336 N 0.63 1.25 -0.50 4.15 2.04 -1.86 -1.12 117.51 122.10 3itv h ILE 336 Ca 0.61 -0.88 -0.10 0.00 1.00 0.00 0.00 64.86 65.50 3itv h ILE 336 Cb 1.09 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 3itv h ILE 336 CO -0.45 0.33 -0.06 -0.33 0.00 0.00 0.00 178.15 177.64 3itv h GLU 337 N 0.84 0.92 -0.64 2.37 5.08 -1.62 -1.32 114.58 120.21 3itv h GLU 337 Ca 0.19 -0.32 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 3itv h GLU 337 Cb 0.33 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 3itv h GLU 337 CO 0.00 0.98 0.16 0.77 -1.00 0.00 0.00 179.01 179.92 3itv h SER 338 N 0.78 0.97 -0.24 1.42 0.02 -1.15 -1.54 113.55 113.81 3itv h SER 338 Ca 0.13 -0.23 -0.08 0.00 -0.84 0.00 0.00 61.79 60.77 3itv h SER 338 Cb 0.60 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 3itv h SER 338 CO 0.04 0.95 -0.11 -0.07 -1.14 0.00 0.00 176.83 176.49 3itv h LEU 339 N 0.95 0.62 0.45 5.07 3.38 -1.07 0.27 115.31 124.98 3itv h LEU 339 Ca 0.20 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3itv h LEU 339 Cb 0.35 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3itv h LEU 339 CO 0.00 0.76 -0.22 0.40 0.09 0.00 0.00 178.44 179.48 3itv h ILE 340 N 0.58 0.56 0.00 1.22 2.04 -0.86 -0.90 117.51 120.15 3itv h ILE 340 Ca 0.10 -0.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.78 3itv h ILE 340 Cb 0.53 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 3itv h ILE 340 CO 0.03 0.02 -0.25 0.78 0.00 0.00 0.00 178.15 178.73 3itv h ASN 341 N -0.68 0.00 -0.17 1.72 2.35 -1.17 -1.59 115.58 116.04 3itv h ASN 341 Ca -0.06 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.57 3itv h ASN 341 Cb 0.50 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.87 3itv h ASN 341 CO 0.10 0.25 -0.34 0.28 -1.65 0.00 0.00 177.43 176.08 3itv h SER 342 N 0.00 0.60 -0.64 5.81 0.02 -0.80 -0.50 113.55 118.04 3itv h SER 342 Ca -0.00 -0.55 -0.04 0.00 -0.84 0.00 0.00 61.79 60.36 3itv h SER 342 Cb 0.65 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.99 3itv h SER 342 CO 0.03 1.03 0.27 0.00 -1.14 0.00 0.00 176.83 177.03 3itv h ALA 343 N 0.58 1.22 -0.55 3.77 0.00 -0.93 -1.20 119.26 122.16 3itv h ALA 343 Ca 0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 3itv h ALA 343 Cb 0.93 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 3itv h ALA 343 CO 0.08 0.57 0.24 -0.91 0.00 0.00 0.00 179.25 179.22 3itv h ASN 344 N 0.96 0.75 -0.12 0.00 -0.26 -1.12 -1.92 115.58 113.87 3itv h ASN 344 Ca 0.23 -0.16 -0.06 0.00 -0.56 0.00 0.00 56.30 55.75 3itv h ASN 344 Cb 0.17 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.23 3itv h ASN 344 CO -0.02 0.70 -0.09 -0.08 -1.06 0.00 0.00 177.43 176.88 3itv h GLU 345 N 0.75 0.43 -0.34 0.81 4.57 -0.51 0.84 114.58 121.14 3itv h GLU 345 Ca 0.19 -0.11 -0.09 0.00 -1.18 0.00 0.00 59.36 58.16 3itv h GLU 345 Cb 0.18 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 3itv h GLU 345 CO -0.02 0.53 -0.16 0.82 -1.18 0.00 0.00 179.01 179.01 3itv h ILE 346 N 0.41 1.29 -0.07 2.32 2.04 -0.88 -1.80 117.51 120.82 3itv h ILE 346 Ca 0.08 -1.27 -0.08 0.00 1.00 0.00 0.00 64.86 64.59 3itv h ILE 346 Cb 0.41 1.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 3itv h ILE 346 CO 0.02 0.41 -0.34 0.03 0.00 0.00 0.00 178.15 178.28 3itv h ARG 347 N 0.48 0.14 -0.12 2.37 3.08 -0.92 -2.13 114.38 117.28 3itv h ARG 347 Ca 0.08 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 3itv h ARG 347 Cb 0.69 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 3itv h ARG 347 CO 0.05 0.47 0.05 -0.09 -1.07 0.00 0.00 179.97 179.37 3itv h ARG 348 N 0.12 0.17 -0.67 0.04 2.43 -0.53 0.57 114.38 116.52 3itv h ARG 348 Ca 0.02 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 3itv h ARG 348 Cb 0.66 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 3itv h ARG 348 CO 0.05 0.27 0.21 0.00 -1.51 0.00 0.00 179.97 178.98 3itv h ALA 349 N 0.89 1.09 -0.07 2.80 0.00 -1.18 -1.20 119.26 121.59 3itv h ALA 349 Ca 0.04 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 3itv h ALA 349 Cb 0.16 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3itv h ALA 349 CO -0.00 0.62 0.03 -0.92 0.00 0.00 0.00 179.25 178.97 3itv h TYR 350 N 0.99 0.11 -0.56 0.00 3.20 -1.18 -0.99 116.97 118.55 3itv h TYR 350 Ca 0.22 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.11 3itv h TYR 350 Cb 0.29 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.48 3itv h TYR 350 CO 0.02 0.25 0.33 0.00 -1.64 0.00 0.00 178.16 177.12 3itv h ALA 351 N 0.85 0.73 -0.57 1.82 0.00 -0.62 -1.13 119.26 120.35 3itv h ALA 351 Ca 0.02 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 3itv h ALA 351 Cb 0.19 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3itv h ALA 351 CO -0.00 0.03 0.08 1.96 0.00 0.00 0.00 179.25 181.32 3itv h GLN 352 N 0.64 0.92 -0.16 0.00 4.20 -1.11 -1.92 115.11 117.67 3itv h GLN 352 Ca 0.23 -0.22 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 3itv h GLN 352 Cb 0.07 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 3itv h GLN 352 CO -0.12 0.86 -0.10 0.00 -0.67 0.00 0.00 178.83 178.79 3itv h ALA 353 N 1.22 1.54 0.00 3.87 0.00 -0.45 -1.45 119.26 123.99 3itv h ALA 353 Ca 0.18 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3itv h ALA 353 Cb 0.39 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3itv h ALA 353 CO 0.01 0.33 -0.08 -0.07 0.00 0.00 0.00 179.25 179.44 3itv h LEU 354 N 0.23 0.00 0.00 0.00 3.38 -0.43 -2.87 115.31 115.63 3itv h LEU 354 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3itv h LEU 354 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3itv h LEU 354 CO 0.02 0.08 -0.12 -0.07 0.09 0.00 0.00 178.44 178.44 3itv h LEU 355 N 0.00 0.00 -9.61 1.67 3.38 -1.00 -3.46 115.31 106.28 3itv h LEU 355 Ca -0.00 -0.03 -0.55 0.00 0.09 0.00 0.00 57.88 57.39 3itv h LEU 355 Cb 0.52 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.33 3itv h LEU 355 CO 0.01 0.02 0.92 0.52 0.09 0.00 0.00 178.44 180.00 3itv n VAL 356 N -2.36 0.11 -2.56 1.22 0.31 -1.09 -4.81 118.33 109.16 3itv n VAL 356 Ca 0.05 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 63.94 3itv n VAL 356 Cb 0.45 -1.82 -0.03 0.00 -0.91 0.00 0.00 33.84 31.53 3itv n VAL 356 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3itv s ASP 357 N 1.00 6.37 0.27 4.52 -1.08 -1.26 -4.85 116.67 121.64 3itv s ASP 357 Ca 0.75 -1.08 -0.03 0.00 -0.52 0.00 0.00 52.55 51.68 3itv s ASP 357 Cb -0.57 -2.56 0.40 0.00 -1.46 0.00 0.00 42.92 38.73 3itv s ASP 357 CO 0.36 -1.63 1.91 0.03 0.52 0.00 0.00 175.17 176.36 3itv h ARG 358 N 9.88 1.16 -0.31 4.34 2.47 -1.96 -0.11 114.38 129.85 3itv h ARG 358 Ca 0.02 -0.07 -0.04 0.00 -1.26 0.00 0.00 59.98 58.63 3itv h ARG 358 Cb 1.03 -0.26 -0.01 0.00 -1.65 0.00 0.00 29.97 29.07 3itv h ARG 358 CO 1.37 0.77 0.05 0.00 0.56 0.00 0.00 179.97 182.72 3itv h ALA 359 N 1.45 0.42 -0.40 0.04 0.00 -1.99 -0.42 119.26 118.36 3itv h ALA 359 Ca 0.39 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 3itv h ALA 359 Cb 0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3itv h ALA 359 CO -0.13 0.11 0.11 0.00 0.00 0.00 0.00 179.25 179.35 3itv h ALA 360 N 0.88 0.52 -0.18 0.00 0.00 -1.89 -1.80 119.26 116.80 3itv h ALA 360 Ca 0.10 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.85 3itv h ALA 360 Cb 0.35 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3itv h ALA 360 CO 0.01 0.18 0.03 1.25 0.00 0.00 0.00 179.25 180.72 3itv h LEU 361 N 0.50 0.01 -0.72 0.00 5.85 -0.89 -0.82 115.31 119.24 3itv h LEU 361 Ca 0.13 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.94 3itv h LEU 361 Cb 0.28 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.29 3itv h LEU 361 CO -0.00 0.03 0.40 -1.28 -0.34 0.00 0.00 178.44 177.25 3itv h SER 362 N 0.11 0.59 -0.45 1.25 0.87 -0.94 -0.18 113.55 114.80 3itv h SER 362 Ca 0.08 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 3itv h SER 362 Cb 0.08 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 3itv h SER 362 CO -0.11 0.37 0.27 1.23 -0.53 0.00 0.00 176.83 178.06 3itv h GLY 363 N 0.72 0.64 2.00 5.77 0.00 -0.70 -0.53 103.07 110.98 3itv h GLY 363 Ca 0.33 -0.26 -0.07 0.00 0.00 0.00 0.00 47.33 47.32 3itv h GLY 363 CO -0.20 0.26 -0.35 -0.97 0.00 0.00 0.00 176.54 175.28 3itv h TYR 364 N 0.59 0.00 -0.07 5.60 0.05 -0.55 -1.68 116.97 120.91 3itv h TYR 364 Ca 0.16 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.87 3itv h TYR 364 Cb -0.01 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.73 3itv h TYR 364 CO -0.03 0.35 -0.23 1.96 -1.05 0.00 0.00 178.16 179.15 3itv h GLN 365 N 0.00 0.29 -0.22 4.88 4.20 -0.56 0.37 115.11 124.06 3itv h GLN 365 Ca -0.00 -0.21 -0.05 0.00 0.06 0.00 0.00 58.65 58.45 3itv h GLN 365 Cb 0.73 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 3itv h GLN 365 CO 0.05 0.84 -0.07 0.93 -0.67 0.00 0.00 178.83 179.90 3itv h GLU 366 N -0.21 0.34 -0.06 1.46 4.39 -0.97 -2.16 114.58 117.38 3itv h GLU 366 Ca -0.01 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.62 3itv h GLU 366 Cb 0.86 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 3itv h GLU 366 CO 0.05 0.43 0.00 -0.25 -1.16 0.00 0.00 179.01 178.08 3itv n ASP 367 N -4.29 1.39 -3.36 1.42 8.00 -0.65 -4.94 116.55 114.12 3itv n ASP 367 Ca 0.00 -1.52 -0.24 0.00 0.71 0.00 0.00 54.79 53.74 3itv n ASP 367 Cb 0.25 -0.03 0.04 0.00 -0.02 0.00 0.00 41.12 41.35 3itv n ASP 367 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3itv n ASN 368 N 0.10 -5.53 -4.36 -2.24 3.02 -0.79 -4.90 115.26 100.57 3itv n ASN 368 Ca 0.18 -0.44 -0.44 0.00 -0.03 0.00 0.00 54.58 53.85 3itv n ASN 368 Cb 0.32 -4.44 0.00 0.00 -0.61 0.00 0.00 39.78 35.05 3itv n ASN 368 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3itv n ASP 369 N -2.64 5.39 -0.29 6.41 -0.08 0.05 -4.86 116.55 120.53 3itv n ASP 369 Ca -0.04 -3.03 0.04 0.00 -1.51 0.00 0.00 54.79 50.24 3itv n ASP 369 Cb 0.58 -1.48 0.18 0.00 2.34 0.00 0.00 41.12 42.73 3itv n ASP 369 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3itv h ALA 370 N 6.77 1.20 -0.14 -1.67 0.00 -1.91 -0.96 119.26 122.55 3itv h ALA 370 Ca 0.27 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 3itv h ALA 370 Cb 0.84 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3itv h ALA 370 CO 1.19 0.08 0.05 1.25 0.00 0.00 0.00 179.25 181.83 3itv h LEU 371 N 0.78 0.20 -0.96 0.00 6.46 -1.96 -1.53 115.31 118.30 3itv h LEU 371 Ca 0.41 -0.17 -0.09 0.00 -0.12 0.00 0.00 57.88 57.91 3itv h LEU 371 Cb 0.40 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 3itv h LEU 371 CO -0.26 0.31 -0.42 0.24 -0.62 0.00 0.00 178.44 177.69 3itv h MET 372 N 0.07 0.00 -0.26 1.25 2.86 -1.91 -1.20 114.93 115.74 3itv h MET 372 Ca 0.05 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.64 3itv h MET 372 Cb 0.18 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 3itv h MET 372 CO -0.00 0.42 -0.01 0.00 1.06 0.00 0.00 176.91 178.38 3itv h ALA 373 N 1.58 0.35 -0.25 6.32 0.00 -0.96 0.26 119.26 126.56 3itv h ALA 373 Ca -0.00 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 3itv h ALA 373 Cb 0.90 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3itv h ALA 373 CO 0.05 0.09 -0.36 0.00 0.00 0.00 0.00 179.25 179.03 3itv h THR 374 N 0.23 1.29 0.00 0.00 1.03 -1.14 -2.50 112.91 111.83 3itv h THR 374 Ca 0.07 -1.50 -0.08 0.00 -0.01 0.00 0.00 66.41 64.89 3itv h THR 374 Cb 0.44 1.49 -0.01 0.00 -1.07 0.00 0.00 68.15 69.00 3itv h THR 374 CO 0.02 0.48 -0.36 -0.08 -0.01 0.00 0.00 175.52 175.56 3itv h GLU 375 N 0.48 0.00 -0.41 0.00 4.57 -1.05 -0.86 114.58 117.30 3itv h GLU 375 Ca 0.05 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.13 3itv h GLU 375 Cb 0.85 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.43 3itv h GLU 375 CO 0.07 0.36 -0.15 1.15 -1.18 0.00 0.00 179.01 179.27 3itv h THR 376 N 0.00 1.26 -0.19 0.32 2.02 -0.49 0.61 112.91 116.44 3itv h THR 376 Ca -0.00 -1.21 -0.15 0.00 0.77 0.00 0.00 66.41 65.81 3itv h THR 376 Cb 0.71 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 3itv h THR 376 CO 0.05 0.41 -0.47 -0.07 0.37 0.00 0.00 175.52 175.81 3itv h LEU 377 N 0.68 0.74 -1.37 2.58 3.38 -1.19 -3.21 115.31 116.92 3itv h LEU 377 Ca 0.11 -0.57 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 3itv h LEU 377 Cb 0.63 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 3itv h LEU 377 CO 0.04 1.18 0.03 0.11 0.09 0.00 0.00 178.44 179.89 3itv h LYS 378 N 0.34 0.45 -0.23 1.13 1.79 -0.87 -1.15 116.57 118.03 3itv h LYS 378 Ca -0.00 -0.08 -0.02 0.00 -2.18 0.00 0.00 60.65 58.37 3itv h LYS 378 Cb 1.08 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.64 3itv h LYS 378 CO 0.10 0.46 0.07 0.00 -1.08 0.00 0.00 179.45 179.00 3itv h ARG 379 N 0.44 0.32 0.00 3.15 3.08 -0.88 0.32 114.38 120.81 3itv h ARG 379 Ca 0.10 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 3itv h ARG 379 Cb 0.24 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3itv h ARG 379 CO 0.00 0.29 -0.01 0.00 -1.07 0.00 0.00 179.97 179.18 3itv h ALA 380 N 1.76 -0.00 -0.55 0.04 0.00 -1.47 -3.30 119.26 115.75 3itv h ALA 380 Ca 0.08 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 3itv h ALA 380 Cb 0.10 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3itv h ALA 380 CO -0.01 -0.00 0.34 -0.92 0.00 0.00 0.00 179.25 178.66 3itv h TYR 381 N -0.98 0.71 0.00 0.00 3.20 -0.97 -2.04 116.97 116.89 3itv h TYR 381 Ca -0.00 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 3itv h TYR 381 Cb 1.00 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 39.03 3itv h TYR 381 CO 0.27 0.47 -0.04 0.00 -1.64 0.00 0.00 178.16 177.22 3itv h ARG 382 N 0.75 0.00 -6.51 1.82 3.08 -0.49 -3.44 114.38 109.59 3itv h ARG 382 Ca 0.20 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.72 3itv h ARG 382 Cb -0.04 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.03 3itv h ARG 382 CO -0.04 0.04 0.81 0.99 -1.07 0.00 0.00 179.97 180.70 3itv s THR 383 N -3.72 3.22 -0.64 2.04 2.01 -0.77 -4.94 115.64 112.84 3itv s THR 383 Ca 0.01 0.82 -0.26 0.00 0.31 0.00 0.00 61.69 62.56 3itv s THR 383 Cb 0.10 -3.52 0.04 0.00 0.01 0.00 0.00 72.50 69.12 3itv s THR 383 CO 0.55 0.04 1.16 -0.62 -0.69 0.00 0.00 174.62 175.06 3itv s ASP 384 N 1.43 6.30 0.00 3.53 2.15 -1.26 -4.86 116.67 123.96 3itv s ASP 384 Ca 0.67 -0.29 0.15 0.00 0.43 0.00 0.00 52.55 53.51 3itv s ASP 384 Cb -0.37 -2.52 0.46 0.00 -0.30 0.00 0.00 42.92 40.19 3itv s ASP 384 CO 0.30 -1.56 1.37 1.33 -0.17 0.00 0.00 175.17 176.44 3itv n VAL 385 N 6.41 0.45 -0.34 1.11 0.24 -1.26 -4.39 118.33 120.55 3itv n VAL 385 Ca 0.04 -0.49 0.14 0.00 -2.04 0.00 0.00 64.34 61.99 3itv n VAL 385 Cb 0.48 0.32 0.35 0.00 -1.47 0.00 0.00 33.84 33.52 3itv n VAL 385 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3itv h GLU 386 N 2.38 0.70 -0.49 7.34 4.57 -1.97 0.52 114.58 127.63 3itv h GLU 386 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 3itv h GLU 386 Cb 0.54 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.95 3itv h GLU 386 CO 0.00 0.47 0.32 -1.35 -1.18 0.00 0.00 179.01 177.27 3itv h PRO 387 N 0.72 0.65 -0.22 0.92 0.11 -1.92 0.78 132.00 133.05 3itv h PRO 387 Ca 0.56 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.55 3itv h PRO 387 Cb 0.93 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.89 3itv h PRO 387 CO -0.35 0.44 -0.19 0.82 -0.21 0.00 0.00 178.00 178.51 3itv h ILE 388 N 0.67 1.32 -0.52 4.15 1.08 -1.25 -1.07 117.51 121.90 3itv h ILE 388 Ca 0.18 -1.33 -0.02 0.00 -0.39 0.00 0.00 64.86 63.30 3itv h ILE 388 Cb -0.07 1.70 -0.02 0.00 -3.07 0.00 0.00 36.82 35.36 3itv h ILE 388 CO -0.04 0.41 0.26 -0.07 -0.69 0.00 0.00 178.15 178.02 3itv h LEU 389 N 0.20 0.66 -0.53 1.44 4.07 -0.85 -0.38 115.31 119.92 3itv h LEU 389 Ca 0.04 -0.12 -0.08 0.00 0.08 0.00 0.00 57.88 57.80 3itv h LEU 389 Cb 0.72 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 42.28 3itv h LEU 389 CO 0.05 0.59 0.03 0.00 -1.08 0.00 0.00 178.44 178.03 3itv h ALA 390 N 1.10 0.71 -0.28 1.53 0.00 -0.84 -1.98 119.26 119.50 3itv h ALA 390 Ca 0.18 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 3itv h ALA 390 Cb 0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3itv h ALA 390 CO -0.02 0.51 -0.39 1.49 0.00 0.00 0.00 179.25 180.83 3itv h GLU 391 N 0.80 0.65 -0.53 0.00 4.57 -1.06 -0.02 114.58 118.99 3itv h GLU 391 Ca 0.15 -0.33 -0.00 0.00 -1.18 0.00 0.00 59.36 58.00 3itv h GLU 391 Cb 0.49 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.06 3itv h GLU 391 CO 0.02 0.93 0.31 0.00 -1.18 0.00 0.00 179.01 179.09 3itv h ALA 392 N 1.03 0.67 -0.11 2.92 0.00 -0.92 -1.37 119.26 121.49 3itv h ALA 392 Ca 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3itv h ALA 392 Cb 0.91 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 3itv h ALA 392 CO 0.08 0.16 0.02 0.00 0.00 0.00 0.00 179.25 179.51 3itv h ARG 393 N 0.71 0.18 -0.65 0.00 3.08 -1.14 -2.91 114.38 113.63 3itv h ARG 393 Ca 0.19 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 60.26 3itv h ARG 393 Cb -0.01 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 29.96 3itv h ARG 393 CO -0.03 0.37 0.34 -0.09 -1.07 0.00 0.00 179.97 179.48 3itv h ARG 394 N -0.05 0.59 -0.03 0.04 2.43 -0.73 0.53 114.38 117.16 3itv h ARG 394 Ca 0.03 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3itv h ARG 394 Cb 0.28 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3itv h ARG 394 CO 0.00 0.39 0.00 2.89 -1.51 0.00 0.00 179.97 181.74 3itv n ARG 395 N -4.84 1.28 -0.06 0.20 1.85 -0.54 -3.46 116.66 111.08 3itv n ARG 395 Ca 0.09 -0.40 0.04 0.00 -1.00 0.00 0.00 57.85 56.57 3itv n ARG 395 Cb 0.21 -1.44 0.07 0.00 -1.05 0.00 0.00 32.46 30.25 3itv n ARG 395 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 3itv n THR 396 N -0.47 1.29 -0.12 8.89 -2.24 -0.82 -4.97 114.28 115.84 3itv n THR 396 Ca 0.20 -1.36 0.00 0.00 -2.27 0.00 0.00 64.05 60.62 3itv n THR 396 Cb 0.20 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 3itv n THR 396 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3itv n GLY 397 N -0.61 0.58 0.00 3.38 0.00 -1.05 -4.99 105.19 102.50 3itv n GLY 397 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3itv n GLY 397 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3itv n GLY 398 N -2.01 0.59 3.73 -0.02 0.00 0.18 -4.81 105.19 102.85 3itv n GLY 398 Ca 0.00 -1.92 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 3itv n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3itv s ALA 399 N -2.88 3.43 0.19 4.61 0.00 -0.36 -4.17 121.76 122.57 3itv s ALA 399 Ca 0.00 -0.79 -0.12 0.00 0.00 0.00 0.00 51.96 51.05 3itv s ALA 399 Cb 0.00 -1.57 0.15 0.00 0.00 0.00 0.00 23.12 21.70 3itv s ALA 399 CO 0.00 0.61 1.81 0.28 0.00 0.00 0.00 175.76 178.46 3itv h VAL 400 N 3.98 1.02 -3.12 0.00 2.07 -1.88 -3.31 116.25 115.00 3itv h VAL 400 Ca -0.51 -0.22 -0.62 0.00 0.82 0.00 0.00 66.70 66.17 3itv h VAL 400 Cb 1.20 0.33 -0.40 0.00 -1.52 0.00 0.00 31.29 30.89 3itv h VAL 400 CO 0.56 0.12 -0.71 -0.62 0.02 0.00 0.00 177.57 176.93 3itv s ASP 401 N -5.59 3.88 0.17 0.57 -1.08 -1.26 -4.67 116.67 108.69 3itv s ASP 401 Ca -0.13 -2.63 -0.22 0.00 -0.52 0.00 0.00 52.55 49.06 3itv s ASP 401 Cb 0.14 -1.19 0.07 0.00 -1.46 0.00 0.00 42.92 40.48 3itv s ASP 401 CO 0.75 -0.27 1.61 -0.65 0.52 0.00 0.00 175.17 177.12 3itv h PRO 402 N 6.81 -0.21 -0.51 4.34 0.11 -1.86 -1.16 132.00 139.53 3itv h PRO 402 Ca -0.04 0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.01 3itv h PRO 402 Cb 0.93 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 3itv h PRO 402 CO 0.53 -0.14 0.01 0.28 -0.21 0.00 0.00 178.00 178.48 3itv h VAL 403 N -0.22 1.25 -0.67 3.15 2.07 -1.95 0.68 116.25 120.56 3itv h VAL 403 Ca 0.18 -1.02 -0.04 0.00 0.82 0.00 0.00 66.70 66.64 3itv h VAL 403 Cb 0.50 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 3itv h VAL 403 CO -0.50 0.36 0.27 0.00 0.02 0.00 0.00 177.57 177.72 3itv h ALA 404 N 1.22 0.88 -0.32 1.67 0.00 -1.89 -0.19 119.26 120.62 3itv h ALA 404 Ca 0.15 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 3itv h ALA 404 Cb 0.46 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3itv h ALA 404 CO 0.02 0.49 -0.41 1.15 0.00 0.00 0.00 179.25 180.50 3itv h THR 405 N 0.95 1.28 -0.46 0.00 2.02 -0.91 -1.22 112.91 114.57 3itv h THR 405 Ca 0.22 -1.59 0.01 0.00 0.77 0.00 0.00 66.41 65.83 3itv h THR 405 Cb 0.20 1.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 3itv h THR 405 CO -0.02 0.52 0.29 0.22 0.37 0.00 0.00 175.52 176.90 3itv h TYR 406 N 0.64 0.55 -0.46 3.16 3.20 -0.45 -0.94 116.97 122.68 3itv h TYR 406 Ca 0.05 0.01 -0.13 0.00 3.14 0.00 0.00 58.73 61.81 3itv h TYR 406 Cb 0.97 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 3itv h TYR 406 CO 0.05 0.33 -0.22 0.00 -1.64 0.00 0.00 178.16 176.69 3itv h ARG 407 N 0.59 0.93 0.00 1.82 3.08 -0.90 -2.84 114.38 117.06 3itv h ARG 407 Ca 0.18 -0.39 -0.05 0.00 0.07 0.00 0.00 59.98 59.79 3itv h ARG 407 Cb -0.03 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 3itv h ARG 407 CO -0.06 1.05 -0.24 0.00 -1.07 0.00 0.00 179.97 179.65 3itv h ALA 408 N 0.94 1.61 0.00 0.04 0.00 -0.89 -2.49 119.26 118.46 3itv h ALA 408 Ca 0.11 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 3itv h ALA 408 Cb 0.78 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 3itv h ALA 408 CO 0.06 0.30 -0.36 0.66 0.00 0.00 0.00 179.25 179.92 3itv h SER 409 N 0.00 0.00 -0.33 0.00 4.64 -0.94 -3.47 113.55 113.45 3itv h SER 409 Ca -0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.19 3itv h SER 409 Cb 0.42 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.47 3itv h SER 409 CO 0.03 0.36 -0.11 0.61 -0.87 0.00 0.00 176.83 176.84 3itv n GLY 410 N 0.29 0.79 0.25 -0.77 0.00 -0.94 -4.94 105.19 99.87 3itv n GLY 410 Ca 0.00 -0.77 0.01 0.00 0.00 0.00 0.00 46.02 45.26 3itv n GLY 410 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3itv h TYR 411 N 0.00 0.45 -0.54 1.61 5.03 -1.85 -0.55 116.97 121.11 3itv h TYR 411 Ca -0.12 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.21 3itv h TYR 411 Cb 0.45 -0.10 -0.03 0.00 1.55 0.00 0.00 36.73 38.60 3itv h TYR 411 CO 0.17 0.11 0.33 -0.09 -1.32 0.00 0.00 178.16 177.36 3itv h ARG 412 N 0.44 0.74 -0.19 1.82 9.65 -1.92 -0.34 114.38 124.58 3itv h ARG 412 Ca 0.33 -0.06 -0.07 0.00 -1.10 0.00 0.00 59.98 59.08 3itv h ARG 412 Cb 0.43 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.84 3itv h ARG 412 CO -0.32 0.53 -0.20 0.00 2.80 0.00 0.00 179.97 182.78 3itv h ALA 413 N 1.17 1.31 0.37 2.80 0.00 -1.84 -0.73 119.26 122.33 3itv h ALA 413 Ca 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3itv h ALA 413 Cb -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3itv h ALA 413 CO -0.04 0.46 -0.18 -0.09 0.00 0.00 0.00 179.25 179.41 3itv h ARG 414 N 0.31 -0.48 0.00 0.00 2.43 -0.14 -2.64 114.38 113.86 3itv h ARG 414 Ca 0.05 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 3itv h ARG 414 Cb 0.52 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 3itv h ARG 414 CO 0.03 -0.23 -0.20 -0.39 -1.51 0.00 0.00 179.97 177.68 3itv h VAL 415 N -0.66 0.56 -0.55 0.20 -1.51 -1.00 -2.51 116.25 110.78 3itv h VAL 415 Ca -0.05 -0.99 -0.05 0.00 -1.23 0.00 0.00 66.70 64.38 3itv h VAL 415 Cb 0.47 1.67 -0.03 0.00 -2.13 0.00 0.00 31.29 31.28 3itv h VAL 415 CO 0.08 0.20 0.15 0.00 -1.23 0.00 0.00 177.57 176.77 3itv h ALA 416 N 1.80 1.23 0.00 5.19 0.00 -0.97 -0.91 119.26 125.59 3itv h ALA 416 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3itv h ALA 416 Cb 0.65 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3itv h ALA 416 CO 0.03 0.54 -0.09 0.00 0.00 0.00 0.00 179.25 179.73 3itv h ALA 417 N 1.36 0.95 0.00 0.00 0.00 -1.09 -3.24 119.26 117.23 3itv h ALA 417 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3itv h ALA 417 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3itv h ALA 417 CO -0.01 0.00 -0.92 0.39 0.00 0.00 0.00 179.25 178.72 3itv n GLU 418 N -2.50 0.08 -4.39 0.00 1.02 -0.82 -4.96 120.64 109.07 3itv n GLU 418 Ca 0.05 -0.01 -0.22 0.00 -0.02 0.00 0.00 57.16 56.95 3itv n GLU 418 Cb 0.46 -1.52 -0.11 0.00 -0.02 0.00 0.00 31.44 30.26 3itv n GLU 418 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3itv s ARG 419 N -3.06 1.45 0.80 3.49 0.52 -0.41 -5.08 118.95 116.67 3itv s ARG 419 Ca 0.07 -1.58 -0.12 0.00 -0.52 0.00 0.00 55.73 53.58 3itv s ARG 419 Cb 0.16 -1.49 0.08 0.00 0.52 0.00 0.00 34.95 34.22 3itv s ARG 419 CO 0.81 0.29 1.15 -2.14 0.02 0.00 0.00 175.30 175.43 3itv s PRO 420 N -3.21 1.82 0.56 3.54 0.02 -1.26 -4.82 135.00 131.65 3itv s PRO 420 Ca 0.22 1.51 -0.15 0.00 0.02 0.00 0.00 61.00 62.61 3itv s PRO 420 Cb -0.05 -1.82 -0.06 0.00 0.02 0.00 0.00 34.50 32.60 3itv s PRO 420 CO 0.10 -2.03 1.01 0.00 -0.33 0.00 0.00 177.00 175.75 3itv s ALA 421 N -2.47 2.97 0.26 -1.55 0.00 -1.26 -4.59 121.76 115.12 3itv s ALA 421 Ca 0.68 0.18 0.08 0.00 0.00 0.00 0.00 51.96 52.90 3itv s ALA 421 Cb -0.23 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 3itv s ALA 421 CO 0.52 -0.50 0.14 -1.12 0.00 0.00 0.00 175.76 174.80 3itv s SER 422 N -3.23 5.21 0.05 0.00 0.01 -1.26 -5.07 113.70 109.41 3itv s SER 422 Ca 0.59 -0.39 0.08 0.00 1.31 0.00 0.00 55.95 57.54 3itv s SER 422 Cb -0.12 -1.21 -0.03 0.00 0.21 0.00 0.00 66.02 64.87 3itv s SER 422 CO 0.38 -0.04 -0.20 0.68 0.41 0.00 0.00 173.24 174.46 3itv s VAL 423 N -2.20 2.62 0.48 3.43 -7.23 -1.26 -5.03 120.40 111.21 3itv s VAL 423 Ca 0.33 -1.28 -0.21 0.00 -1.81 0.00 0.00 61.98 59.01 3itv s VAL 423 Cb -0.07 -2.09 -0.08 0.00 0.56 0.00 0.00 36.38 34.69 3itv s VAL 423 CO 0.23 0.32 1.05 0.00 -0.31 0.00 0.00 175.10 176.39 3itv s ALA 424 N -0.92 2.88 0.00 1.32 0.00 -1.26 -4.75 121.76 119.02 3itv s ALA 424 Ca 0.14 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.75 3itv s ALA 424 Cb -0.10 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.75 3itv s ALA 424 CO 0.05 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 175.86 3itv n GLY 425 N -0.14 3.32 0.00 0.00 0.00 -1.10 -5.03 105.19 102.24 3itv n GLY 425 Ca 0.09 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.84 3itv n GLY 425 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3itv n GLY 426 N 0.00 -0.21 3.52 -0.02 0.00 -1.26 -1.94 105.19 105.28 3itv n GLY 426 Ca 0.00 -1.66 -0.31 0.00 0.00 0.00 0.00 46.02 44.05 3itv n GLY 426 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3itv n GLY 427 N 5.00 -1.37 0.00 -0.02 0.00 -1.21 -2.74 105.19 104.86 3itv n GLY 427 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 3itv n GLY 427 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3itv n GLY 428 N 0.95 4.27 0.04 -0.02 0.00 -0.86 -4.90 105.19 104.67 3itv n GLY 428 Ca 0.08 -0.89 0.16 0.00 0.00 0.00 0.00 46.02 45.36 3itv n GLY 428 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61