#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 0.97 -5.08 -1.08 2.47 -1.93 -3.38 114.38 106.35 3itv h ARG 5 Ca 0.00 -0.06 -0.64 0.00 -1.26 0.00 0.00 59.98 58.02 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 0.64 -0.63 0.42 0.56 0.00 0.00 179.97 180.96 3itv s ILE 6 N -5.85 4.23 0.14 2.04 1.09 -1.26 -5.04 121.20 116.55 3itv s ILE 6 Ca -0.11 -0.21 -0.35 0.00 -1.10 0.00 0.00 60.65 58.88 3itv s ILE 6 Cb 0.18 -2.94 -0.15 0.00 -1.06 0.00 0.00 42.46 38.49 3itv s ILE 6 CO 0.78 0.40 1.42 0.00 -0.10 0.00 0.00 174.94 177.44 3itv n ALA 7 N 4.38 0.12 0.16 9.38 0.00 -1.26 -4.86 120.51 128.44 3itv n ALA 7 Ca -0.17 0.48 0.07 0.00 0.00 0.00 0.00 53.44 53.82 3itv n ALA 7 Cb 0.52 -2.19 0.57 0.00 0.00 0.00 0.00 19.45 18.35 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 4.92 0.18 0.00 0.00 4.20 -1.97 -1.40 115.11 121.03 3itv h GLN 8 Ca -0.46 -0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.15 3itv h GLN 8 Cb 1.30 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.03 3itv h GLN 8 CO 0.81 0.12 -0.42 0.38 -0.67 0.00 0.00 178.83 179.04 3itv h ASP 9 N 0.18 0.00 -0.11 1.46 2.03 -1.99 -0.50 116.42 117.49 3itv h ASP 9 Ca 0.06 0.00 -0.13 0.00 -0.73 0.00 0.00 57.03 56.24 3itv h ASP 9 Cb 0.04 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.54 3itv h ASP 9 CO -0.01 0.42 -0.42 0.58 -1.03 0.00 0.00 179.24 178.78 3itv h VAL 10 N 0.00 1.38 -0.36 4.15 2.07 -1.63 -0.75 116.25 121.11 3itv h VAL 10 Ca -0.00 -1.75 -0.01 0.00 0.82 0.00 0.00 66.70 65.75 3itv h VAL 10 Cb 0.78 2.18 -0.02 0.00 -1.52 0.00 0.00 31.29 32.72 3itv h VAL 10 CO 0.05 0.52 0.19 0.58 0.02 0.00 0.00 177.57 178.93 3itv h VAL 11 N 0.06 1.15 -0.34 2.57 2.07 -1.25 -0.93 116.25 119.58 3itv h VAL 11 Ca -0.02 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 3itv h VAL 11 Cb 1.06 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 3itv h VAL 11 CO 0.09 0.16 0.17 0.00 0.02 0.00 0.00 177.57 178.01 3itv h ALA 12 N 1.04 0.44 -0.08 1.67 0.00 -1.10 -1.43 119.26 119.80 3itv h ALA 12 Ca 0.12 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3itv h ALA 12 Cb 0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3itv h ALA 12 CO -0.02 -0.01 -0.03 -0.09 0.00 0.00 0.00 179.25 179.10 3itv h ARG 13 N 0.42 -0.02 0.00 0.00 2.43 -0.91 -0.41 114.38 115.89 3itv h ARG 13 Ca 0.12 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.27 3itv h ARG 13 Cb 0.10 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 3itv h ARG 13 CO -0.02 -0.01 -0.12 0.93 -1.51 0.00 0.00 179.97 179.24 3itv h GLU 14 N -0.02 0.00 0.09 0.20 4.39 -1.09 -1.71 114.58 116.44 3itv h GLU 14 Ca 0.04 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.55 3itv h GLU 14 Cb 0.08 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.75 3itv h GLU 14 CO -0.09 0.12 -0.79 -0.91 -1.16 0.00 0.00 179.01 176.18 3itv h ASN 15 N 0.00 0.54 -0.56 1.42 2.35 -0.81 -3.20 115.58 115.32 3itv h ASN 15 Ca -0.00 -0.87 -0.02 0.00 -0.55 0.00 0.00 56.30 54.86 3itv h ASN 15 Cb 0.58 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 3itv h ASN 15 CO 0.02 1.36 0.28 0.44 -1.65 0.00 0.00 177.43 177.87 3itv h ASP 16 N -0.20 0.75 0.15 5.81 3.32 -0.87 0.14 116.42 125.52 3itv h ASP 16 Ca -0.12 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.83 3itv h ASP 16 Cb 1.56 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 40.92 3itv h ASP 16 CO 0.15 0.64 -0.09 -0.09 -1.72 0.00 0.00 179.24 178.12 3itv h ARG 17 N 0.83 0.00 -0.12 3.56 2.43 -1.37 -2.80 114.38 116.90 3itv h ARG 17 Ca 0.21 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 3itv h ARG 17 Cb 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 3itv h ARG 17 CO -0.03 0.09 0.00 0.54 -1.51 0.00 0.00 179.97 179.07 3itv n ARG 18 N -4.09 1.39 -0.21 0.20 1.74 -0.73 -4.72 116.66 110.24 3itv n ARG 18 Ca -0.03 -1.41 -0.07 0.00 -0.77 0.00 0.00 57.85 55.58 3itv n ARG 18 Cb 0.18 -1.18 0.03 0.00 -1.02 0.00 0.00 32.46 30.47 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 1.59 0.77 0.02 7.54 0.00 -0.48 -2.31 119.26 126.38 3itv h ALA 19 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3itv h ALA 19 Cb 0.49 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3itv h ALA 19 CO 0.00 0.27 -0.01 1.03 0.00 0.00 0.00 179.25 180.54 3itv h SER 20 N 0.81 -0.02 -0.84 0.00 0.87 -1.85 -1.19 113.55 111.33 3itv h SER 20 Ca 0.21 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.68 3itv h SER 20 Cb 0.02 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 61.95 3itv h SER 20 CO -0.04 0.07 0.49 0.00 -0.53 0.00 0.00 176.83 176.82 3itv h ALA 21 N 0.87 1.07 -0.63 6.23 0.00 -1.89 -2.03 119.26 122.89 3itv h ALA 21 Ca -0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 3itv h ALA 21 Cb 0.10 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3itv h ALA 21 CO 0.00 0.55 0.27 1.25 0.00 0.00 0.00 179.25 181.32 3itv h LEU 22 N 1.16 0.85 -0.61 0.00 5.85 -1.25 -0.69 115.31 120.62 3itv h LEU 22 Ca 0.30 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.88 3itv h LEU 22 Cb -0.02 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 3itv h LEU 22 CO -0.05 0.78 0.39 0.50 -0.34 0.00 0.00 178.44 179.71 3itv h LYS 23 N 0.87 0.75 -0.23 1.25 3.64 -0.82 0.25 116.57 122.28 3itv h LYS 23 Ca 0.21 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.54 3itv h LYS 23 Cb 0.18 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 3itv h LYS 23 CO -0.02 0.49 0.11 0.93 -2.27 0.00 0.00 179.45 178.69 3itv h GLU 24 N 0.77 0.33 -0.50 1.90 4.39 -0.95 -1.31 114.58 119.20 3itv h GLU 24 Ca 0.24 -0.05 -0.11 0.00 0.34 0.00 0.00 59.36 59.78 3itv h GLU 24 Cb -0.02 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 3itv h GLU 24 CO -0.08 0.35 -0.12 -0.44 -1.16 0.00 0.00 179.01 177.56 3itv h ASP 25 N 0.23 0.97 -0.42 1.42 3.32 -0.78 -1.70 116.42 119.46 3itv h ASP 25 Ca 0.08 -0.36 -0.07 0.00 0.02 0.00 0.00 57.03 56.70 3itv h ASP 25 Cb 0.13 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 3itv h ASP 25 CO -0.01 1.10 -0.00 0.22 -1.72 0.00 0.00 179.24 178.83 3itv h TYR 26 N 0.82 0.81 -0.43 4.55 3.20 -0.45 -0.61 116.97 124.86 3itv h TYR 26 Ca 0.13 -0.14 -0.11 0.00 3.14 0.00 0.00 58.73 61.75 3itv h TYR 26 Cb 0.68 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 3itv h TYR 26 CO 0.05 0.81 -0.17 0.93 -1.64 0.00 0.00 178.16 178.14 3itv h GLU 27 N 0.58 0.82 -0.30 1.82 5.08 -1.22 0.11 114.58 121.47 3itv h GLU 27 Ca 0.12 -0.31 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 3itv h GLU 27 Cb 0.49 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 3itv h GLU 27 CO 0.02 0.93 0.09 0.00 -1.00 0.00 0.00 179.01 179.05 3itv h ALA 28 N 1.08 0.40 -0.44 3.43 0.00 -1.14 -1.22 119.26 121.36 3itv h ALA 28 Ca 0.11 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3itv h ALA 28 Cb 0.69 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3itv h ALA 28 CO 0.05 0.04 -0.13 1.25 0.00 0.00 0.00 179.25 180.46 3itv h LEU 29 N 0.33 0.81 -0.80 0.00 5.85 -0.95 -1.79 115.31 118.76 3itv h LEU 29 Ca 0.10 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.55 3itv h LEU 29 Cb 0.26 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 3itv h LEU 29 CO -0.00 0.95 0.47 1.23 -0.34 0.00 0.00 178.44 180.75 3itv h GLY 30 N 0.97 1.17 1.08 3.75 0.00 -0.53 0.91 103.07 110.41 3itv h GLY 30 Ca 0.12 -0.50 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 3itv h GLY 30 CO 0.04 0.48 -0.05 0.00 0.00 0.00 0.00 176.54 177.01 3itv h ALA 31 N 1.25 0.76 -0.27 3.60 0.00 -0.98 -0.91 119.26 122.71 3itv h ALA 31 Ca 0.29 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3itv h ALA 31 Cb -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 3itv h ALA 31 CO -0.05 0.64 0.10 -0.97 0.00 0.00 0.00 179.25 178.97 3itv h ASN 32 N 0.91 0.38 -0.39 0.00 -0.73 -0.85 -2.23 115.58 112.66 3itv h ASN 32 Ca 0.15 -0.18 -0.06 0.00 1.87 0.00 0.00 56.30 58.08 3itv h ASN 32 Cb 0.61 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 39.08 3itv h ASN 32 CO 0.04 0.45 0.03 -0.07 -0.37 0.00 0.00 177.43 177.51 3itv h LEU 33 N 0.28 0.72 -0.97 0.34 3.38 -0.71 -2.47 115.31 115.89 3itv h LEU 33 Ca 0.09 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3itv h LEU 33 Cb 0.20 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 3itv h LEU 33 CO -0.01 0.77 0.51 0.00 0.09 0.00 0.00 178.44 179.80 3itv h ALA 34 N 1.31 1.22 0.00 1.53 0.00 -0.94 0.24 119.26 122.62 3itv h ALA 34 Ca 0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3itv h ALA 34 Cb 0.40 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3itv h ALA 34 CO 0.01 0.65 -0.04 0.00 0.00 0.00 0.00 179.25 179.87 3itv h ARG 35 N 1.24 0.00 -0.55 0.00 3.08 -0.96 -0.99 114.38 116.20 3itv h ARG 35 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 3itv h ARG 35 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.04 3itv h ARG 35 CO -0.05 0.04 0.00 0.54 -1.07 0.00 0.00 179.97 179.43 3itv n ARG 36 N -3.23 2.45 -1.60 0.04 1.74 0.07 -4.94 116.66 111.20 3itv n ARG 36 Ca -0.01 -2.23 -0.07 0.00 -0.77 0.00 0.00 57.85 54.77 3itv n ARG 36 Cb 0.23 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.16 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 1.50 0.55 3.27 -0.13 0.00 -0.37 -5.03 105.19 104.97 3itv n GLY 37 Ca 0.21 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.28 2.13 -0.44 1.61 1.01 0.63 -4.98 120.40 118.07 3itv s VAL 38 Ca 0.00 -1.03 -0.20 0.00 0.00 0.00 0.00 61.98 60.75 3itv s VAL 38 Cb 0.00 -1.78 0.02 0.00 0.00 0.00 0.00 36.38 34.62 3itv s VAL 38 CO 0.00 0.57 0.61 -0.62 0.00 0.00 0.00 175.10 175.65 3itv s ASP 39 N -0.09 6.30 0.38 3.32 2.15 -1.26 -2.68 116.67 124.78 3itv s ASP 39 Ca -0.06 -0.41 0.11 0.00 0.43 0.00 0.00 52.55 52.62 3itv s ASP 39 Cb -0.14 -2.30 0.89 0.00 -0.30 0.00 0.00 42.92 41.07 3itv s ASP 39 CO 0.04 -0.75 1.88 -0.29 -0.17 0.00 0.00 175.17 175.88 3itv h ILE 40 N 5.85 0.81 -0.73 4.11 -0.00 -1.92 -1.01 117.51 124.62 3itv h ILE 40 Ca -0.26 -0.21 0.00 0.00 -0.00 0.00 0.00 64.86 64.40 3itv h ILE 40 Cb 1.10 0.15 -0.04 0.00 -0.00 0.00 0.00 36.82 38.03 3itv h ILE 40 CO 0.88 0.11 0.47 -0.08 -0.00 0.00 0.00 178.15 179.53 3itv h GLU 41 N 0.61 0.98 -0.35 2.19 4.57 -1.98 -0.65 114.58 119.94 3itv h GLU 41 Ca 0.43 -0.07 -0.09 0.00 -1.18 0.00 0.00 59.36 58.46 3itv h GLU 41 Cb 0.79 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.15 3itv h GLU 41 CO -0.19 0.66 -0.14 0.00 -1.18 0.00 0.00 179.01 178.17 3itv h ALA 42 N 1.52 1.10 -0.07 2.92 0.00 -1.60 -1.36 119.26 121.77 3itv h ALA 42 Ca 0.27 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3itv h ALA 42 Cb -0.09 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3itv h ALA 42 CO -0.06 0.56 -0.19 0.28 0.00 0.00 0.00 179.25 179.84 3itv h VAL 43 N 0.57 1.42 -0.93 0.00 2.07 -1.25 -3.02 116.25 115.11 3itv h VAL 43 Ca 0.10 -1.54 0.04 0.00 0.82 0.00 0.00 66.70 66.12 3itv h VAL 43 Cb 0.57 2.26 -0.06 0.00 -1.52 0.00 0.00 31.29 32.54 3itv h VAL 43 CO 0.04 0.43 0.60 0.74 0.02 0.00 0.00 177.57 179.40 3itv h THR 44 N -0.25 1.14 -0.98 2.57 2.02 -1.05 -0.34 112.91 116.02 3itv h THR 44 Ca -0.00 -0.40 0.05 0.00 0.77 0.00 0.00 66.41 66.83 3itv h THR 44 Cb 0.80 -0.12 -0.06 0.00 -1.74 0.00 0.00 68.15 67.03 3itv h THR 44 CO 0.04 0.21 0.64 0.00 0.37 0.00 0.00 175.52 176.78 3itv h ALA 45 N 1.39 1.32 -0.02 6.16 0.00 -1.26 -0.71 119.26 126.15 3itv h ALA 45 Ca 0.38 -0.04 -0.24 0.00 0.00 0.00 0.00 54.91 55.01 3itv h ALA 45 Cb 0.03 -0.33 0.02 0.00 0.00 0.00 0.00 17.79 17.51 3itv h ALA 45 CO -0.13 0.49 -0.93 0.87 0.00 0.00 0.00 179.25 179.55 3itv h LYS 46 N 1.21 0.67 -0.94 0.00 1.57 -1.23 -3.25 116.57 114.59 3itv h LYS 46 Ca 0.40 -0.69 0.01 0.00 -1.87 0.00 0.00 60.65 58.51 3itv h LYS 46 Cb 0.06 0.19 -0.05 0.00 0.08 0.00 0.00 32.23 32.51 3itv h LYS 46 CO -0.14 1.28 0.62 0.28 -0.57 0.00 0.00 179.45 180.92 3itv h VAL 47 N 0.33 1.23 0.00 0.50 2.07 -0.74 -1.52 116.25 118.12 3itv h VAL 47 Ca -0.11 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 66.97 3itv h VAL 47 Cb 1.59 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 3itv h VAL 47 CO 0.18 0.23 0.00 -0.33 0.02 0.00 0.00 177.57 177.68 3itv h GLU 48 N 1.27 0.00 -0.34 1.57 5.08 -1.17 -1.85 114.58 119.13 3itv h GLU 48 Ca 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 3itv h GLU 48 Cb -0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.12 3itv h GLU 48 CO -0.08 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.56 3itv n LYS 49 N -2.98 2.30 -3.08 2.33 5.02 -0.59 -4.93 118.16 116.23 3itv n LYS 49 Ca -0.03 -2.02 -0.41 0.00 -2.02 0.00 0.00 58.31 53.83 3itv n LYS 49 Cb 0.07 -1.36 -0.06 0.00 -0.02 0.00 0.00 35.03 33.66 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 -1.11 3.27 0.10 2.13 5.36 -0.70 -5.04 117.98 121.98 3itv s PHE 50 Ca 0.29 0.80 0.10 0.00 -0.96 0.00 0.00 56.93 57.15 3itv s PHE 50 Cb 0.16 -2.91 -0.03 0.00 -0.34 0.00 0.00 43.02 39.90 3itv s PHE 50 CO 0.22 -0.37 -0.25 -0.06 -1.46 0.00 0.00 175.22 173.29 3itv s PHE 51 N 2.58 2.20 -0.01 10.12 0.08 -1.26 -4.73 117.98 126.96 3itv s PHE 51 Ca 0.27 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.93 3itv s PHE 51 Cb -0.15 -1.24 0.01 0.00 -0.57 0.00 0.00 43.02 41.07 3itv s PHE 51 CO 0.09 0.24 -0.00 0.54 -0.10 0.00 0.00 175.22 175.99 3itv s VAL 52 N -0.98 0.13 0.35 -0.44 0.11 -0.25 -4.69 120.40 114.63 3itv s VAL 52 Ca 0.12 0.02 -0.26 0.00 -2.93 0.00 0.00 61.98 58.93 3itv s VAL 52 Cb -0.10 -0.17 -0.09 0.00 -1.53 0.00 0.00 36.38 34.49 3itv s VAL 52 CO 0.04 0.09 1.08 0.00 -3.33 0.00 0.00 175.10 172.97 3itv s ALA 53 N 0.50 3.21 -0.12 1.54 0.00 -0.13 -4.19 121.76 122.57 3itv s ALA 53 Ca -0.05 0.79 -0.07 0.00 0.00 0.00 0.00 51.96 52.64 3itv s ALA 53 Cb -0.07 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 3itv s ALA 53 CO -0.01 -0.22 0.13 0.14 0.00 0.00 0.00 175.76 175.80 3itv s VAL 54 N -1.45 5.41 -0.04 0.00 -7.23 -0.52 -0.70 120.40 115.87 3itv s VAL 54 Ca 0.53 0.17 -0.28 0.00 -1.81 0.00 0.00 61.98 60.59 3itv s VAL 54 Cb -0.26 -3.35 -0.03 0.00 0.56 0.00 0.00 36.38 33.29 3itv s VAL 54 CO 0.33 0.62 0.92 -2.16 -0.31 0.00 0.00 175.10 174.50 3itv s PRO 55 N -0.99 4.50 0.37 4.82 0.04 -1.25 -0.49 135.00 142.00 3itv s PRO 55 Ca 0.15 1.29 0.04 0.00 0.04 0.00 0.00 61.00 62.51 3itv s PRO 55 Cb -0.12 -3.47 0.71 0.00 0.04 0.00 0.00 34.50 31.65 3itv s PRO 55 CO 0.04 -0.08 2.02 0.66 0.04 0.00 0.00 177.00 179.68 3itv h SER 56 N 6.86 0.65 0.00 6.66 4.64 -1.71 -0.36 113.55 130.29 3itv h SER 56 Ca -0.39 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 3itv h SER 56 Cb 1.20 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 3itv h SER 56 CO 0.77 0.47 0.00 -2.67 -0.87 0.00 0.00 176.83 174.53 3itv n TRP 57 N -4.45 0.00 0.61 4.77 2.14 -1.26 -3.15 117.44 116.10 3itv n TRP 57 Ca 0.06 0.00 0.07 0.00 2.07 0.00 0.00 57.50 59.70 3itv n TRP 57 Cb 0.05 0.00 -0.09 0.00 -0.81 0.00 0.00 31.31 30.46 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 0.51 -0.42 0.09 -1.67 0.00 -0.15 -4.46 105.19 99.09 3itv n GLY 58 Ca 0.11 -0.41 0.13 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.43 0.49 -3.92 1.61 0.24 -1.19 -4.63 118.33 109.50 3itv n VAL 59 Ca 0.02 -0.26 -0.24 0.00 -2.04 0.00 0.00 64.34 61.81 3itv n VAL 59 Cb 0.25 -0.44 -0.03 0.00 -1.47 0.00 0.00 33.84 32.15 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 -3.56 1.55 0.30 7.63 0.00 -1.26 -4.61 107.32 107.37 3itv s GLY 60 Ca 0.10 -1.08 -0.29 0.00 0.00 0.00 0.00 44.72 43.45 3itv s GLY 60 CO 0.63 -1.08 1.35 -1.59 0.00 0.00 0.00 173.10 172.41 3itv s THR 61 N -1.84 2.70 0.40 0.90 2.01 -1.26 -4.62 115.64 113.92 3itv s THR 61 Ca 0.35 0.66 0.03 0.00 0.31 0.00 0.00 61.69 63.04 3itv s THR 61 Cb -0.10 -3.42 0.07 0.00 0.01 0.00 0.00 72.50 69.06 3itv s THR 61 CO 0.29 0.14 0.55 0.61 -0.69 0.00 0.00 174.62 175.52 3itv n GLY 62 N 1.23 1.29 3.78 4.40 0.00 -0.20 -4.94 105.19 110.74 3itv n GLY 62 Ca 0.02 -2.09 -0.09 0.00 0.00 0.00 0.00 46.02 43.86 3itv n GLY 62 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3itv s GLY 63 N -3.82 0.42 0.35 -0.02 0.00 -1.26 -4.37 107.32 98.62 3itv s GLY 63 Ca 0.38 -0.76 0.02 0.00 0.00 0.00 0.00 44.72 44.36 3itv s GLY 63 CO 0.25 -0.36 0.17 -1.30 0.00 0.00 0.00 173.10 171.86 3itv n THR 64 N -0.52 0.00 0.46 0.90 -2.24 -0.34 -4.99 114.28 107.55 3itv n THR 64 Ca -0.06 -1.49 0.10 0.00 -2.27 0.00 0.00 64.05 60.33 3itv n THR 64 Cb 0.60 0.00 0.43 0.00 -2.10 0.00 0.00 70.33 69.26 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 -1.15 0.12 0.01 -0.78 1.85 -1.26 -2.91 116.66 112.53 3itv n ARG 65 Ca -0.06 0.34 -0.14 0.00 -1.00 0.00 0.00 57.85 56.98 3itv n ARG 65 Cb 0.42 -1.72 -0.14 0.00 -1.05 0.00 0.00 32.46 29.96 3itv n ARG 65 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 3itv h PHE 66 N 0.00 0.24 -1.04 2.89 0.04 -2.05 -3.50 116.94 113.52 3itv h PHE 66 Ca 0.00 -0.17 0.37 0.00 2.80 0.00 0.00 57.97 60.97 3itv h PHE 66 Cb 0.35 -0.01 -0.16 0.00 2.20 0.00 0.00 35.95 38.32 3itv h PHE 66 CO 0.00 1.32 0.98 0.00 -0.60 0.00 0.00 178.31 180.01 3itv s ALA 67 N -2.59 -2.39 -0.04 2.45 0.00 -1.15 -5.15 121.76 112.88 3itv s ALA 67 Ca -0.11 1.31 0.02 0.00 0.00 0.00 0.00 51.96 53.18 3itv s ALA 67 Cb 0.07 -0.00 0.02 0.00 0.00 0.00 0.00 23.12 23.21 3itv s ALA 67 CO 0.81 -0.87 -0.07 0.50 0.00 0.00 0.00 175.76 176.13 3itv s ARG 68 N -2.04 1.06 -0.63 0.00 3.52 -1.26 -1.20 118.95 118.40 3itv s ARG 68 Ca 0.14 -0.22 0.04 0.00 -0.13 0.00 0.00 55.73 55.55 3itv s ARG 68 Cb 0.05 -0.98 0.15 0.00 -1.56 0.00 0.00 34.95 32.61 3itv s ARG 68 CO -0.05 -0.01 0.40 -0.06 -0.81 0.00 0.00 175.30 174.77 3itv s PHE 69 N 0.69 3.41 0.57 5.12 0.40 -1.26 -5.06 117.98 121.84 3itv s PHE 69 Ca -0.11 -3.23 -0.21 0.00 -0.60 0.00 0.00 56.93 52.79 3itv s PHE 69 Cb -0.14 -2.81 -0.04 0.00 0.51 0.00 0.00 43.02 40.54 3itv s PHE 69 CO 0.01 -0.66 1.33 -1.25 0.70 0.00 0.00 175.22 175.36 3itv s PRO 70 N -0.88 3.03 0.00 0.24 0.04 -1.26 -4.96 135.00 131.22 3itv s PRO 70 Ca 0.21 2.16 0.00 0.00 0.04 0.00 0.00 61.00 63.41 3itv s PRO 70 Cb -0.15 -2.16 0.00 0.00 0.04 0.00 0.00 34.50 32.23 3itv s PRO 70 CO -0.08 -1.25 0.00 0.41 0.04 0.00 0.00 177.00 176.11 3itv n GLY 71 N 0.74 1.23 3.90 0.56 0.00 -1.26 -5.09 105.19 105.27 3itv n GLY 71 Ca 0.12 -1.97 -0.28 0.00 0.00 0.00 0.00 46.02 43.88 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 1.10 4.89 -1.47 2.61 -4.23 -1.26 -4.27 115.64 113.02 3itv s THR 72 Ca 0.00 0.28 -0.12 0.00 -1.18 0.00 0.00 61.69 60.67 3itv s THR 72 Cb 0.00 -3.82 0.06 0.00 1.34 0.00 0.00 72.50 70.08 3itv s THR 72 CO 0.00 -0.71 1.06 0.61 -0.54 0.00 0.00 174.62 175.05 3itv n GLY 73 N -1.87 -0.52 3.75 3.99 0.00 -1.26 -4.77 105.19 104.51 3itv n GLY 73 Ca 0.01 0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 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 -6.51 4.25 0.29 1.61 0.41 -1.26 -4.71 118.70 112.78 3itv s GLU 74 Ca 0.64 2.35 -0.30 0.00 -0.41 0.00 0.00 54.97 57.25 3itv s GLU 74 Cb -0.31 -3.08 -0.11 0.00 -1.78 0.00 0.00 34.13 28.86 3itv s GLU 74 CO 0.79 -0.42 1.50 -1.25 -0.49 0.00 0.00 175.26 175.39 3itv s PRO 75 N -0.78 4.18 0.00 0.39 0.04 -1.26 -4.89 135.00 132.69 3itv s PRO 75 Ca 0.58 2.46 0.26 0.00 0.04 0.00 0.00 61.00 64.33 3itv s PRO 75 Cb -0.43 -3.05 0.64 0.00 0.04 0.00 0.00 34.50 31.71 3itv s PRO 75 CO 0.47 -0.51 1.50 0.54 0.04 0.00 0.00 177.00 179.04 3itv n ARG 76 N 1.85 1.18 -3.03 4.56 1.74 -1.26 -4.95 116.66 116.75 3itv n ARG 76 Ca 0.06 -0.78 0.00 0.00 -0.77 0.00 0.00 57.85 56.36 3itv n ARG 76 Cb 0.39 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 3itv n ARG 76 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3itv n GLY 77 N 1.32 -1.19 0.37 -0.13 0.00 -1.26 -5.01 105.19 99.29 3itv n GLY 77 Ca 0.13 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 0.00 1.20 -0.73 -0.61 6.09 -1.92 -1.21 117.51 120.33 3itv h ILE 78 Ca 0.00 -0.41 -0.03 0.00 -1.37 0.00 0.00 64.86 63.05 3itv h ILE 78 Cb 0.00 -0.11 -0.03 0.00 0.47 0.00 0.00 36.82 37.15 3itv h ILE 78 CO 0.00 0.22 0.33 -0.26 -3.07 0.00 0.00 178.15 175.37 3itv h PHE 79 N 1.20 1.08 -0.61 2.19 0.04 -1.97 0.41 116.94 119.28 3itv h PHE 79 Ca 0.35 -0.06 -0.08 0.00 2.80 0.00 0.00 57.97 60.98 3itv h PHE 79 Cb -0.07 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 37.73 3itv h PHE 79 CO -0.00 0.81 0.06 -0.44 -0.60 0.00 0.00 178.31 178.13 3itv h ASP 80 N 1.04 1.00 -0.98 2.17 3.32 -1.85 -2.27 116.42 118.84 3itv h ASP 80 Ca 0.25 -0.28 0.02 0.00 0.02 0.00 0.00 57.03 57.04 3itv h ASP 80 Cb 0.15 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.38 3itv h ASP 80 CO -0.03 1.03 0.65 0.11 -1.72 0.00 0.00 179.24 179.28 3itv h LYS 81 N 0.93 1.27 -0.59 3.56 1.57 -0.50 -0.87 116.57 121.93 3itv h LYS 81 Ca 0.18 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 3itv h LYS 81 Cb 0.48 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 3itv h LYS 81 CO 0.02 0.84 0.09 -0.07 -0.57 0.00 0.00 179.45 179.76 3itv h LEU 82 N 1.30 0.95 -0.79 2.94 3.38 -0.69 0.24 115.31 122.65 3itv h LEU 82 Ca 0.37 -0.26 0.05 0.00 0.09 0.00 0.00 57.88 58.12 3itv h LEU 82 Cb -0.10 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.34 3itv h LEU 82 CO -0.09 0.97 0.49 0.44 0.09 0.00 0.00 178.44 180.34 3itv h ASP 83 N 0.89 0.78 -0.02 -0.43 3.32 -0.77 -0.43 116.42 119.76 3itv h ASP 83 Ca 0.18 0.01 -0.17 0.00 0.02 0.00 0.00 57.03 57.07 3itv h ASP 83 Cb 0.43 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 3itv h ASP 83 CO 0.01 0.52 -0.57 0.44 -1.72 0.00 0.00 179.24 177.92 3itv h ASP 84 N 0.92 0.69 -0.14 6.45 3.32 -0.83 -2.90 116.42 123.93 3itv h ASP 84 Ca 0.33 -0.38 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 3itv h ASP 84 Cb 0.09 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 3itv h ASP 84 CO -0.14 1.11 -0.00 0.00 -1.72 0.00 0.00 179.24 178.49 3itv h ALA 86 N 1.64 1.88 -0.29 0.00 0.00 -0.88 -1.76 119.26 119.85 3itv h ALA 86 Ca 0.08 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 3itv h ALA 86 Cb 0.25 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3itv h ALA 86 CO 0.01 0.11 -0.09 0.28 0.00 0.00 0.00 179.25 179.55 3itv h VAL 87 N 0.20 1.29 -0.35 0.00 2.07 -1.34 -0.42 116.25 117.70 3itv h VAL 87 Ca 0.06 -1.15 0.02 0.00 0.82 0.00 0.00 66.70 66.45 3itv h VAL 87 Cb -0.02 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3itv h VAL 87 CO -0.01 0.37 0.19 0.40 0.02 0.00 0.00 177.57 178.53 3itv h ILE 88 N 0.33 1.01 -0.31 4.57 2.04 -1.29 -1.74 117.51 122.13 3itv h ILE 88 Ca 0.07 -0.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.75 3itv h ILE 88 Cb 0.59 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 3itv h ILE 88 CO 0.03 0.07 -0.00 -0.61 0.00 0.00 0.00 178.15 177.64 3itv h GLN 89 N 0.39 0.56 -0.93 2.37 5.75 -1.34 -0.79 115.11 121.11 3itv h GLN 89 Ca 0.14 -0.18 0.02 0.00 -0.15 0.00 0.00 58.65 58.48 3itv h GLN 89 Cb 0.03 -0.05 -0.05 0.00 1.07 0.00 0.00 27.48 28.48 3itv h GLN 89 CO -0.08 0.70 0.61 0.37 -2.65 0.00 0.00 178.83 177.78 3itv h GLN 90 N 0.35 1.19 0.11 1.69 4.15 -0.87 0.42 115.11 122.15 3itv h GLN 90 Ca 0.09 -0.07 -0.30 0.00 0.77 0.00 0.00 58.65 59.14 3itv h GLN 90 Cb 0.45 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 3itv h GLN 90 CO 0.02 0.79 -1.47 -0.07 -1.93 0.00 0.00 178.83 176.17 3itv h LEU 91 N 1.23 0.36 0.00 -2.39 3.38 -1.26 -3.34 115.31 113.28 3itv h LEU 91 Ca 0.35 -0.48 -0.19 0.00 0.09 0.00 0.00 57.88 57.66 3itv h LEU 91 Cb -0.09 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 3itv h LEU 91 CO -0.09 1.39 -2.19 0.35 0.09 0.00 0.00 178.44 177.99 3itv n THR 92 N -3.44 0.72 -1.54 0.22 -2.24 -0.31 -1.14 114.28 106.54 3itv n THR 92 Ca -0.14 -0.68 -0.19 0.00 -2.27 0.00 0.00 64.05 60.77 3itv n THR 92 Cb 1.04 -0.24 -0.08 0.00 -2.10 0.00 0.00 70.33 68.95 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 -2.51 -1.44 0.00 -0.78 5.12 0.15 -4.78 116.66 112.42 3itv n ARG 93 Ca -0.19 1.12 0.04 0.00 -1.93 0.00 0.00 57.85 56.89 3itv n ARG 93 Cb 0.87 -5.48 0.03 0.00 -1.16 0.00 0.00 32.46 26.72 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 1.19 2.49 -3.00 7.54 0.00 -1.26 -4.77 120.51 122.70 3itv n ALA 94 Ca -0.19 -0.55 -0.21 0.00 0.00 0.00 0.00 53.44 52.49 3itv n ALA 94 Cb 0.63 -0.25 -0.03 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 0.39 1.35 0.31 0.00 -2.24 -1.26 -1.09 114.28 111.74 3itv n THR 95 Ca 0.04 -4.87 0.16 0.00 -2.27 0.00 0.00 64.05 57.11 3itv n THR 95 Cb 0.18 -0.69 0.73 0.00 -2.10 0.00 0.00 70.33 68.45 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 2.96 0.00 -6.66 -0.78 0.13 -1.86 -3.40 132.00 122.39 3itv h PRO 96 Ca 0.11 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.55 3itv h PRO 96 Cb 0.80 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 31.71 3itv h PRO 96 CO 0.65 0.00 -0.83 -0.80 -0.23 0.00 0.00 178.00 176.79 3itv s ASN 97 N -4.88 3.62 -0.04 1.44 0.02 -1.26 -0.05 114.94 113.78 3itv s ASN 97 Ca 0.00 -0.50 0.04 0.00 -1.02 0.00 0.00 52.86 51.38 3itv s ASN 97 Cb 0.09 -0.50 -0.03 0.00 0.02 0.00 0.00 41.25 40.84 3itv s ASN 97 CO 0.41 0.24 -0.16 -0.69 0.02 0.00 0.00 177.10 176.93 3itv s VAL 98 N -0.93 2.95 -0.24 1.60 1.01 0.17 -1.44 120.40 123.52 3itv s VAL 98 Ca 0.14 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 61.18 3itv s VAL 98 Cb -0.10 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 3itv s VAL 98 CO 0.05 0.57 0.33 -0.44 0.00 0.00 0.00 175.10 175.61 3itv s SER 99 N -0.78 6.29 0.15 3.32 0.01 0.36 -0.95 113.70 122.10 3itv s SER 99 Ca 0.12 0.33 -0.02 0.00 1.31 0.00 0.00 55.95 57.69 3itv s SER 99 Cb -0.11 -2.20 -0.05 0.00 0.21 0.00 0.00 66.02 63.88 3itv s SER 99 CO 0.01 -0.09 0.35 -0.76 0.41 0.00 0.00 173.24 173.16 3itv s LEU 100 N 1.56 4.27 -0.09 2.44 1.43 -1.25 -1.72 118.68 125.32 3itv s LEU 100 Ca 0.15 0.42 0.02 0.00 -1.03 0.00 0.00 54.13 53.69 3itv s LEU 100 Cb -0.15 -3.16 0.01 0.00 0.03 0.00 0.00 46.19 42.92 3itv s LEU 100 CO 0.08 0.03 -0.15 -2.28 0.23 0.00 0.00 176.35 174.26 3itv s HIS 101 N -1.73 1.84 -0.07 0.29 2.46 -1.26 -1.33 115.29 115.48 3itv s HIS 101 Ca 0.38 -0.79 0.01 0.00 0.47 0.00 0.00 55.06 55.14 3itv s HIS 101 Cb -0.12 -1.32 -0.03 0.00 -0.13 0.00 0.00 32.58 30.98 3itv s HIS 101 CO 0.27 -0.39 -0.07 0.42 -2.47 0.00 0.00 174.74 172.50 3itv s ILE 102 N 0.80 3.65 -2.14 0.89 -1.09 -0.38 -0.17 121.20 122.75 3itv s ILE 102 Ca -0.11 -0.49 0.20 0.00 -2.23 0.00 0.00 60.65 58.02 3itv s ILE 102 Cb -0.16 -2.50 0.51 0.00 -1.58 0.00 0.00 42.46 38.74 3itv s ILE 102 CO 0.02 0.59 1.66 -0.81 -1.23 0.00 0.00 174.94 175.16 3itv n PRO 103 N 2.36 1.36 -0.28 2.79 -0.04 -1.26 -2.33 135.00 137.59 3itv n PRO 103 Ca -0.18 -0.53 0.08 0.00 -0.04 0.00 0.00 63.50 62.83 3itv n PRO 103 Cb 0.53 -1.35 0.23 0.00 -0.04 0.00 0.00 33.50 32.87 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 1.10 0.63 -0.67 0.54 6.55 -1.91 -1.01 115.95 121.17 3itv h TRP 104 Ca 0.00 0.04 -0.17 0.00 0.95 0.00 0.00 58.89 59.71 3itv h TRP 104 Cb 0.24 -0.15 -0.10 0.00 -0.86 0.00 0.00 29.16 28.29 3itv h TRP 104 CO 0.05 0.07 0.22 -0.25 -1.05 0.00 0.00 178.44 177.47 3itv n ASP 105 N -4.97 4.77 -4.71 -3.49 8.00 0.76 -4.79 116.55 112.12 3itv n ASP 105 Ca 0.17 -3.08 -0.42 0.00 0.71 0.00 0.00 54.79 52.17 3itv n ASP 105 Cb 0.49 -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 -1.59 -0.39 0.00 0.00 177.20 175.22 3itv s LYS 106 N -2.77 4.19 -0.01 -1.24 -2.85 -0.39 -4.92 119.74 111.77 3itv s LYS 106 Ca 0.51 2.41 -0.30 0.00 -1.00 0.00 0.00 55.97 57.60 3itv s LYS 106 Cb 0.40 -3.26 0.11 0.00 -2.06 0.00 0.00 37.83 33.02 3itv s LYS 106 CO 0.13 -0.67 1.13 0.00 0.10 0.00 0.00 175.35 176.04 3itv s ALA 107 N 1.56 -1.99 -0.26 0.59 0.00 -1.26 -4.99 121.76 115.41 3itv s ALA 107 Ca 0.72 0.79 -0.32 0.00 0.00 0.00 0.00 51.96 53.15 3itv s ALA 107 Cb -0.44 0.34 -0.09 0.00 0.00 0.00 0.00 23.12 22.93 3itv s ALA 107 CO 0.32 -0.90 2.17 -3.47 0.00 0.00 0.00 175.76 173.88 3itv n ASP 108 N -0.36 2.82 -0.34 0.00 2.03 -1.26 -4.82 116.55 114.61 3itv n ASP 108 Ca -0.06 0.38 0.16 0.00 0.52 0.00 0.00 54.79 55.79 3itv n ASP 108 Cb 0.61 -1.41 0.38 0.00 -0.72 0.00 0.00 41.12 39.98 3itv n ASP 108 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3itv h PRO 109 N 13.25 0.62 -0.78 -0.67 0.11 -1.96 -0.04 132.00 142.52 3itv h PRO 109 Ca -0.36 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.71 3itv h PRO 109 Cb 1.28 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 3itv h PRO 109 CO 0.98 0.41 0.48 -0.22 -0.21 0.00 0.00 178.00 179.44 3itv h LYS 110 N 0.64 1.06 -0.25 1.05 1.63 -1.87 -1.44 116.57 117.38 3itv h LYS 110 Ca 0.58 -0.09 -0.17 0.00 -0.85 0.00 0.00 60.65 60.12 3itv h LYS 110 Cb 1.08 -0.22 -0.00 0.00 -0.60 0.00 0.00 32.23 32.48 3itv h LYS 110 CO -0.37 0.74 -0.54 0.93 -3.45 0.00 0.00 179.45 176.77 3itv h GLU 111 N 1.07 0.75 -0.55 1.90 5.08 -1.43 -1.77 114.58 119.63 3itv h GLU 111 Ca 0.28 -0.47 0.01 0.00 -1.00 0.00 0.00 59.36 58.18 3itv h GLU 111 Cb -0.05 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 3itv h GLU 111 CO -0.05 1.09 0.35 -0.07 -1.00 0.00 0.00 179.01 179.33 3itv h LEU 112 N 0.58 0.60 -0.60 1.33 3.38 -0.92 0.66 115.31 120.34 3itv h LEU 112 Ca 0.02 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3itv h LEU 112 Cb 1.12 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 3itv h LEU 112 CO 0.11 0.43 0.17 0.50 0.09 0.00 0.00 178.44 179.74 3itv h LYS 113 N 0.72 0.94 -0.67 1.13 1.63 -1.17 -0.12 116.57 119.03 3itv h LYS 113 Ca 0.21 -0.21 -0.02 0.00 -0.85 0.00 0.00 60.65 59.78 3itv h LYS 113 Cb -0.05 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.42 3itv h LYS 113 CO -0.06 0.85 0.35 0.00 -3.45 0.00 0.00 179.45 177.13 3itv h ALA 114 N 1.05 0.86 -0.42 5.00 0.00 -0.77 -0.18 119.26 124.80 3itv h ALA 114 Ca 0.19 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3itv h ALA 114 Cb 0.31 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3itv h ALA 114 CO -0.00 0.39 0.03 -0.09 0.00 0.00 0.00 179.25 179.58 3itv h ARG 115 N 0.92 0.73 0.11 0.00 9.65 -0.61 -2.08 114.38 123.09 3itv h ARG 115 Ca 0.23 -0.22 0.01 0.00 -1.10 0.00 0.00 59.98 58.90 3itv h ARG 115 Cb 0.07 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.57 3itv h ARG 115 CO -0.03 0.79 -0.12 0.78 2.80 0.00 0.00 179.97 184.18 3itv h GLY 116 N 0.57 -0.24 0.61 2.80 0.00 -0.62 -1.05 103.07 105.14 3itv h GLY 116 Ca 0.12 0.14 0.07 0.00 0.00 0.00 0.00 47.33 47.67 3itv h GLY 116 CO 0.02 -0.13 0.43 -0.55 0.00 0.00 0.00 176.54 176.31 3itv h ASP 117 N -0.27 0.63 -0.05 0.19 3.32 -0.98 0.17 116.42 119.42 3itv h ASP 117 Ca 0.01 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 3itv h ASP 117 Cb 0.26 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3itv h ASP 117 CO -0.05 0.38 -0.11 0.00 -1.72 0.00 0.00 179.24 177.74 3itv h ALA 118 N 1.40 1.41 -0.00 3.45 0.00 -1.02 -2.80 119.26 121.69 3itv h ALA 118 Ca 0.35 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3itv h ALA 118 Cb 0.26 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3itv h ALA 118 CO -0.21 0.41 -0.40 1.28 0.00 0.00 0.00 179.25 180.33 3itv n LEU 119 N -4.25 0.77 -0.16 0.00 4.77 -0.43 -4.89 117.00 112.81 3itv n LEU 119 Ca -0.00 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 3itv n LEU 119 Cb 0.28 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3itv n LEU 119 CO 0.39 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3itv n GLY 120 N 1.43 0.61 3.27 -0.72 0.00 0.03 -4.90 105.19 104.91 3itv n GLY 120 Ca 0.09 -0.79 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.33 2.08 0.00 0.99 1.43 0.38 -4.87 118.68 118.35 3itv s LEU 121 Ca 0.00 -0.46 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 3itv s LEU 121 Cb 0.00 -1.18 0.04 0.00 0.03 0.00 0.00 46.19 45.08 3itv s LEU 121 CO 0.00 0.26 0.32 0.61 0.23 0.00 0.00 176.35 177.77 3itv n GLY 122 N 2.32 2.89 3.19 -3.19 0.00 0.92 -3.80 105.19 107.51 3itv n GLY 122 Ca -0.16 -2.29 -0.29 0.00 0.00 0.00 0.00 46.02 43.27 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 -2.45 2.14 0.00 1.61 0.40 -1.26 -0.65 117.98 117.77 3itv s PHE 123 Ca 0.24 -0.71 0.00 0.00 -0.60 0.00 0.00 56.93 55.86 3itv s PHE 123 Cb -0.02 -1.43 0.00 0.00 0.51 0.00 0.00 43.02 42.08 3itv s PHE 123 CO 0.15 -0.26 0.00 -3.47 0.70 0.00 0.00 175.22 172.35 3itv n ASP 124 N 3.23 0.00 -4.68 1.36 2.03 -0.12 -4.21 116.55 114.15 3itv n ASP 124 Ca -0.19 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.70 3itv n ASP 124 Cb 0.52 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.92 3itv n ASP 124 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3itv n ALA 125 N -3.00 1.10 -1.82 -1.67 0.00 -1.26 -4.57 120.51 109.28 3itv n ALA 125 Ca 0.00 0.34 -0.33 0.00 0.00 0.00 0.00 53.44 53.45 3itv n ALA 125 Cb 0.00 -2.22 -0.05 0.00 0.00 0.00 0.00 19.45 17.17 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 -1.91 4.06 -0.12 0.00 -1.94 0.32 -3.90 119.30 115.80 3itv s MET 126 Ca 0.57 1.08 0.01 0.00 -1.71 0.00 0.00 55.69 55.64 3itv s MET 126 Cb -0.57 -2.15 0.02 0.00 2.01 0.00 0.00 34.83 34.13 3itv s MET 126 CO 0.61 -0.18 -0.16 -0.80 -0.01 0.00 0.00 175.02 174.48 3itv s ASN 127 N -2.52 2.57 0.49 3.03 0.01 -0.44 -0.29 114.94 117.78 3itv s ASN 127 Ca 0.61 -0.46 -0.05 0.00 -0.71 0.00 0.00 52.86 52.25 3itv s ASN 127 Cb -0.10 -1.15 -0.03 0.00 0.41 0.00 0.00 41.25 40.38 3itv s ASN 127 CO 0.21 0.00 0.79 -0.94 -1.51 0.00 0.00 177.10 175.66 3itv s SER 128 N 1.10 6.18 -0.34 -1.22 1.04 -1.15 -1.25 113.70 118.06 3itv s SER 128 Ca -0.04 0.88 -0.01 0.00 0.48 0.00 0.00 55.95 57.27 3itv s SER 128 Cb -0.14 -2.17 0.12 0.00 0.10 0.00 0.00 66.02 63.92 3itv s SER 128 CO -0.04 -0.63 0.16 0.21 0.98 0.00 0.00 173.24 173.92 3itv s ASN 129 N -4.13 3.60 -0.25 7.02 3.84 -0.98 -4.66 114.94 119.38 3itv s ASN 129 Ca 0.48 -1.86 0.10 0.00 0.21 0.00 0.00 52.86 51.79 3itv s ASN 129 Cb -0.10 -0.67 0.45 0.00 -0.55 0.00 0.00 41.25 40.38 3itv s ASN 129 CO 0.45 -0.37 1.19 0.35 -2.79 0.00 0.00 177.10 175.93 3itv n THR 130 N 4.52 2.22 -0.05 -5.21 -2.24 -1.26 -4.59 114.28 107.66 3itv n THR 130 Ca 0.02 -3.70 0.02 0.00 -2.27 0.00 0.00 64.05 58.12 3itv n THR 130 Cb 0.39 -0.57 0.04 0.00 -2.10 0.00 0.00 70.33 68.09 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 -0.76 0.13 -3.61 4.78 1.16 -1.26 -4.57 117.46 113.33 3itv n PHE 131 Ca 0.32 -0.49 -0.12 0.00 -1.87 0.00 0.00 57.45 55.29 3itv n PHE 131 Cb 0.89 -0.04 -0.05 0.00 -1.61 0.00 0.00 39.48 38.67 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 -0.99 -0.31 -0.14 5.98 1.04 -1.26 -4.94 113.70 113.07 3itv s SER 132 Ca 0.07 -0.13 -0.10 0.00 0.48 0.00 0.00 55.95 56.26 3itv s SER 132 Cb 0.04 0.48 -0.05 0.00 0.10 0.00 0.00 66.02 66.59 3itv s SER 132 CO 0.05 -0.80 0.20 -1.81 0.98 0.00 0.00 173.24 171.86 3itv s ASP 133 N -2.48 6.39 0.22 7.02 1.01 -1.26 -4.84 116.67 122.74 3itv s ASP 133 Ca -0.01 0.45 0.03 0.00 0.71 0.00 0.00 52.55 53.74 3itv s ASP 133 Cb 0.01 -2.12 -0.03 0.00 1.01 0.00 0.00 42.92 41.78 3itv s ASP 133 CO -0.08 0.26 0.36 0.00 0.21 0.00 0.00 175.17 175.91 3itv s ALA 134 N -0.25 3.91 0.33 5.23 0.00 -1.26 -5.06 121.76 124.66 3itv s ALA 134 Ca 0.14 -1.11 -0.29 0.00 0.00 0.00 0.00 51.96 50.70 3itv s ALA 134 Cb -0.12 -1.80 -0.11 0.00 0.00 0.00 0.00 23.12 21.09 3itv s ALA 134 CO 0.03 0.32 1.44 -2.14 0.00 0.00 0.00 175.76 175.41 3itv s PRO 135 N -3.75 4.21 0.00 0.00 0.02 -1.26 -2.55 135.00 131.67 3itv s PRO 135 Ca 0.35 2.43 0.00 0.00 0.02 0.00 0.00 61.00 63.80 3itv s PRO 135 Cb -0.10 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.40 3itv s PRO 135 CO 0.30 -0.43 0.00 0.41 -0.33 0.00 0.00 177.00 176.94 3itv n GLY 136 N 1.06 0.83 3.71 0.52 0.00 -1.26 -5.01 105.19 105.04 3itv n GLY 136 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.06 4.32 0.13 1.61 0.74 -1.06 -4.94 119.66 120.40 3itv s GLN 137 Ca 0.00 2.02 -0.14 0.00 0.05 0.00 0.00 55.36 57.29 3itv s GLN 137 Cb 0.00 -3.35 -0.01 0.00 1.10 0.00 0.00 33.01 30.75 3itv s GLN 137 CO 0.00 -0.46 1.56 0.00 -0.55 0.00 0.00 175.29 175.85 3itv h ALA 138 N 7.10 0.58 -4.01 1.58 0.00 -1.95 -3.44 119.26 119.12 3itv h ALA 138 Ca -0.41 -0.29 -0.61 0.00 0.00 0.00 0.00 54.91 53.60 3itv h ALA 138 Cb 1.20 -0.15 -0.31 0.00 0.00 0.00 0.00 17.79 18.53 3itv h ALA 138 CO 0.87 0.40 -0.86 -1.01 0.00 0.00 0.00 179.25 178.65 3itv s HIS 139 N -4.93 1.97 0.41 0.00 3.76 -1.26 -5.13 115.29 110.11 3itv s HIS 139 Ca -0.13 -0.55 -0.22 0.00 -0.15 0.00 0.00 55.06 54.01 3itv s HIS 139 Cb 0.10 -1.31 -0.11 0.00 1.11 0.00 0.00 32.58 32.38 3itv s HIS 139 CO 0.81 -0.17 0.96 0.45 -0.85 0.00 0.00 174.74 175.94 3itv s SER 140 N -0.10 6.99 -0.13 1.40 0.15 -1.26 -4.97 113.70 115.78 3itv s SER 140 Ca -0.02 1.75 0.15 0.00 0.70 0.00 0.00 55.95 58.53 3itv s SER 140 Cb -0.12 -2.55 0.67 0.00 -1.71 0.00 0.00 66.02 62.31 3itv s SER 140 CO 0.02 -0.32 1.55 -1.22 1.20 0.00 0.00 173.24 174.47 3itv n TYR 141 N -0.38 1.47 -0.23 3.44 4.01 -1.26 -4.55 117.16 119.67 3itv n TYR 141 Ca 0.06 -0.56 0.03 0.00 -0.16 0.00 0.00 57.90 57.27 3itv n TYR 141 Cb 0.53 -0.29 0.15 0.00 -0.31 0.00 0.00 39.34 39.42 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 3.63 0.30 -0.55 -0.72 3.64 -1.95 -1.34 116.57 119.58 3itv h LYS 142 Ca 0.00 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 3itv h LYS 142 Cb 1.45 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.19 3itv h LYS 142 CO 0.27 0.20 0.03 0.66 -2.27 0.00 0.00 179.45 178.34 3itv n TYR 143 N -5.11 1.97 0.00 1.91 4.01 -1.26 -5.04 117.16 113.64 3itv n TYR 143 Ca 0.12 -0.81 0.00 0.00 -0.16 0.00 0.00 57.90 57.05 3itv n TYR 143 Cb 0.39 -0.51 0.00 0.00 -0.31 0.00 0.00 39.34 38.91 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 0.36 1.52 0.00 2.72 0.00 -0.51 -4.65 105.19 104.63 3itv n GLY 144 Ca 0.29 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 44.16 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 0.29 1.61 3.41 -1.26 -4.24 113.62 113.43 3itv n SER 145 Ca 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.79 3itv n SER 145 Cb 0.00 0.00 0.87 0.00 -0.26 0.00 0.00 64.21 64.82 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 -2.96 1.04 3.38 -1.87 -2.64 115.31 112.26 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 -3.22 2.67 -4.70 -0.43 3.41 -1.26 -3.81 113.62 106.28 3itv n SER 147 Ca -0.01 -2.15 -0.38 0.00 -0.26 0.00 0.00 58.87 56.07 3itv n SER 147 Cb 0.22 -0.19 0.05 0.00 -0.26 0.00 0.00 64.21 64.03 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 -0.01 1.76 0.23 7.33 -0.00 -0.99 -4.79 115.22 118.75 3itv n HIS 148 Ca 0.09 0.43 0.10 0.00 -0.00 0.00 0.00 57.72 58.34 3itv n HIS 148 Cb 0.42 -2.27 0.57 0.00 -0.00 0.00 0.00 29.99 28.71 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 0.89 0.67 -3.27 3.57 1.35 -1.91 -3.43 112.91 110.79 3itv h THR 149 Ca -0.50 -0.89 -0.59 0.00 -0.55 0.00 0.00 66.41 63.88 3itv h THR 149 Cb 1.33 1.56 -0.08 0.00 -1.73 0.00 0.00 68.15 69.23 3itv h THR 149 CO 0.54 0.20 0.49 0.21 -0.25 0.00 0.00 175.52 176.71 3itv s ASN 150 N -6.28 6.87 0.25 5.36 2.47 -1.26 -4.96 114.94 117.39 3itv s ASN 150 Ca -0.02 1.08 -0.04 0.00 0.42 0.00 0.00 52.86 54.31 3itv s ASN 150 Cb 0.12 -2.45 0.39 0.00 -1.45 0.00 0.00 41.25 37.86 3itv s ASN 150 CO 0.63 -0.51 1.83 0.00 -3.72 0.00 0.00 177.10 175.32 3itv h ALA 151 N 7.61 1.22 -0.28 1.71 0.00 -1.99 -1.71 119.26 125.81 3itv h ALA 151 Ca -0.23 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 3itv h ALA 151 Cb 1.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 3itv h ALA 151 CO 0.88 0.19 -0.03 0.00 0.00 0.00 0.00 179.25 180.28 3itv h ALA 152 N 1.45 1.43 -0.27 0.00 0.00 -1.96 -0.76 119.26 119.14 3itv h ALA 152 Ca 0.40 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.96 3itv h ALA 152 Cb 0.30 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3itv h ALA 152 CO -0.22 0.40 -0.45 1.15 0.00 0.00 0.00 179.25 180.13 3itv h THR 153 N 0.42 1.29 -0.61 0.00 2.02 -1.69 -1.60 112.91 112.74 3itv h THR 153 Ca 0.09 -1.64 -0.04 0.00 0.77 0.00 0.00 66.41 65.58 3itv h THR 153 Cb 0.33 1.67 -0.03 0.00 -1.74 0.00 0.00 68.15 68.38 3itv h THR 153 CO 0.01 0.53 0.21 0.03 0.37 0.00 0.00 175.52 176.68 3itv h ARG 154 N 0.54 0.92 -0.60 6.66 3.08 -1.00 -1.70 114.38 122.28 3itv h ARG 154 Ca 0.02 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 59.85 3itv h ARG 154 Cb 1.05 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.93 3itv h ARG 154 CO 0.10 0.81 0.23 0.00 -1.07 0.00 0.00 179.97 180.04 3itv h ALA 155 N 1.07 1.27 -0.63 0.04 0.00 -1.06 -0.60 119.26 119.36 3itv h ALA 155 Ca 0.20 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 3itv h ALA 155 Cb 0.25 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3itv h ALA 155 CO -0.01 0.53 0.10 0.37 0.00 0.00 0.00 179.25 180.24 3itv h GLN 156 N 0.87 1.04 -0.55 0.00 4.15 -0.92 -1.02 115.11 118.68 3itv h GLN 156 Ca 0.20 -0.28 -0.11 0.00 0.77 0.00 0.00 58.65 59.23 3itv h GLN 156 Cb 0.19 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.74 3itv h GLN 156 CO -0.02 0.97 -0.09 0.00 -1.93 0.00 0.00 178.83 177.77 3itv h ALA 157 N 1.03 0.80 -0.25 3.38 0.00 -0.74 -1.63 119.26 121.85 3itv h ALA 157 Ca 0.19 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3itv h ALA 157 Cb 0.44 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3itv h ALA 157 CO 0.01 0.67 0.11 0.28 0.00 0.00 0.00 179.25 180.32 3itv h VAL 158 N 0.92 1.16 -0.89 0.00 2.07 -0.88 -2.15 116.25 116.48 3itv h VAL 158 Ca 0.15 -0.47 0.02 0.00 0.82 0.00 0.00 66.70 67.22 3itv h VAL 158 Cb 0.65 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.38 3itv h VAL 158 CO 0.04 0.16 0.59 -0.08 0.02 0.00 0.00 177.57 178.30 3itv h GLU 159 N 0.26 1.12 -0.65 1.57 4.57 -1.02 -1.30 114.58 119.14 3itv h GLU 159 Ca 0.08 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.17 3itv h GLU 159 Cb 0.15 -0.25 -0.03 0.00 -0.16 0.00 0.00 28.75 28.46 3itv h GLU 159 CO -0.01 0.74 0.32 1.25 -1.18 0.00 0.00 179.01 180.13 3itv h HIS 160 N 1.15 0.94 -0.49 0.92 2.76 -1.00 -0.98 115.15 118.45 3itv h HIS 160 Ca 0.34 -0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.40 3itv h HIS 160 Cb -0.05 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 28.60 3itv h HIS 160 CO -0.00 0.70 0.04 -0.91 -1.30 0.00 0.00 177.93 176.46 3itv h ASN 161 N 0.90 0.75 0.07 3.26 2.35 -0.69 -1.62 115.58 120.59 3itv h ASN 161 Ca 0.22 -0.16 -0.09 0.00 -0.55 0.00 0.00 56.30 55.73 3itv h ASN 161 Cb 0.12 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 3itv h ASN 161 CO -0.03 0.79 -0.27 -0.07 -1.65 0.00 0.00 177.43 176.20 3itv h LEU 162 N 0.74 0.33 -0.86 1.61 3.38 -0.78 -2.23 115.31 117.51 3itv h LEU 162 Ca 0.15 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 3itv h LEU 162 Cb 0.39 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3itv h LEU 162 CO 0.01 0.61 -0.23 -0.33 0.09 0.00 0.00 178.44 178.59 3itv h GLU 163 N 0.30 0.58 -0.48 1.13 5.08 -0.52 -2.17 114.58 118.51 3itv h GLU 163 Ca 0.04 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.12 3itv h GLU 163 Cb 0.64 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3itv h GLU 163 CO 0.05 0.77 0.05 0.00 -1.00 0.00 0.00 179.01 178.88 3itv h ILE 165 N 0.72 1.25 -0.70 0.00 2.04 -0.93 -1.23 117.51 118.65 3itv h ILE 165 Ca 0.15 -0.95 -0.05 0.00 1.00 0.00 0.00 64.86 65.02 3itv h ILE 165 Cb 0.37 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 3itv h ILE 165 CO 0.01 0.35 0.25 -0.33 0.00 0.00 0.00 178.15 178.43 3itv h GLU 166 N 0.82 1.06 -0.38 2.37 4.39 -0.94 -0.43 114.58 121.46 3itv h GLU 166 Ca 0.17 -0.20 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 3itv h GLU 166 Cb 0.39 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 3itv h GLU 166 CO 0.01 0.88 0.10 0.82 -1.16 0.00 0.00 179.01 179.66 3itv h ILE 167 N 1.03 1.22 -0.62 3.13 1.08 -1.11 -2.99 117.51 119.25 3itv h ILE 167 Ca 0.23 -0.75 -0.04 0.00 -0.39 0.00 0.00 64.86 63.92 3itv h ILE 167 Cb 0.24 0.98 -0.03 0.00 -3.07 0.00 0.00 36.82 34.95 3itv h ILE 167 CO -0.01 0.26 0.23 1.23 -0.69 0.00 0.00 178.15 179.17 3itv h GLY 168 N 0.47 0.97 2.00 5.37 0.00 -0.76 -2.33 103.07 108.80 3itv h GLY 168 Ca 0.12 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 3itv h GLY 168 CO -0.00 0.48 -0.14 0.50 0.00 0.00 0.00 176.54 177.38 3itv h LYS 169 N 0.89 0.00 0.00 4.80 1.57 -0.95 -0.75 116.57 122.12 3itv h LYS 169 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3itv h LYS 169 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3itv h LYS 169 CO -0.02 0.14 0.00 0.00 -0.57 0.00 0.00 179.45 179.01 3itv h ALA 170 N 1.86 1.00 -0.03 3.86 0.00 -1.31 -3.33 119.26 121.30 3itv h ALA 170 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3itv h ALA 170 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3itv h ALA 170 CO 0.02 0.00 0.00 0.44 0.00 0.00 0.00 179.25 179.71 3itv n ILE 171 N -3.06 0.08 -0.19 0.00 -5.35 -0.86 -4.81 119.36 105.16 3itv n ILE 171 Ca 0.04 -0.54 0.00 0.00 -0.27 0.00 0.00 62.75 61.98 3itv n ILE 171 Cb 0.52 1.13 0.00 0.00 -1.74 0.00 0.00 39.64 39.55 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 0.48 0.90 3.80 3.28 0.00 -0.73 -4.52 105.19 108.41 3itv n GLY 172 Ca 0.05 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.02 6.29 -0.07 1.61 0.15 -0.37 -4.80 113.70 114.50 3itv s SER 173 Ca 0.00 1.90 0.10 0.00 0.70 0.00 0.00 55.95 58.65 3itv s SER 173 Cb 0.00 -2.55 0.18 0.00 -1.71 0.00 0.00 66.02 61.93 3itv s SER 173 CO 0.00 -0.82 1.09 0.29 1.20 0.00 0.00 173.24 175.00 3itv n LYS 174 N -1.11 0.63 -3.49 5.44 4.76 -1.26 -4.49 118.16 118.63 3itv n LYS 174 Ca 0.09 -1.87 -0.14 0.00 -2.87 0.00 0.00 58.31 53.52 3itv n LYS 174 Cb 0.53 -0.95 -0.04 0.00 -1.84 0.00 0.00 35.03 32.73 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 -1.39 -1.74 -0.12 7.82 0.00 -1.26 -2.07 121.76 122.99 3itv s ALA 175 Ca 0.18 1.07 0.02 0.00 0.00 0.00 0.00 51.96 53.23 3itv s ALA 175 Cb 0.17 0.23 0.01 0.00 0.00 0.00 0.00 23.12 23.53 3itv s ALA 175 CO -0.00 -0.52 -0.18 -1.17 0.00 0.00 0.00 175.76 173.89 3itv s LEU 176 N -1.80 1.86 -0.21 0.00 2.96 -0.62 -0.52 118.68 120.35 3itv s LEU 176 Ca -0.04 -0.49 -0.07 0.00 -0.22 0.00 0.00 54.13 53.30 3itv s LEU 176 Cb -0.00 -1.22 -0.04 0.00 0.50 0.00 0.00 46.19 45.43 3itv s LEU 176 CO -0.00 0.04 0.07 -0.89 -1.32 0.00 0.00 176.35 174.24 3itv s THR 177 N 0.92 4.59 -0.31 3.68 2.01 0.60 -0.30 115.64 126.83 3itv s THR 177 Ca -0.07 -0.09 -0.03 0.00 0.31 0.00 0.00 61.69 61.81 3itv s THR 177 Cb -0.15 -3.10 0.05 0.00 0.01 0.00 0.00 72.50 69.30 3itv s THR 177 CO -0.02 0.41 0.02 -0.69 -0.69 0.00 0.00 174.62 173.65 3itv s VAL 178 N 0.89 3.18 -0.11 3.82 1.01 0.11 -2.95 120.40 126.35 3itv s VAL 178 Ca 0.04 -1.32 0.02 0.00 0.00 0.00 0.00 61.98 60.71 3itv s VAL 178 Cb -0.14 -2.82 0.01 0.00 0.00 0.00 0.00 36.38 33.44 3itv s VAL 178 CO 0.03 -0.12 -0.17 0.86 0.00 0.00 0.00 175.10 175.69 3itv s TRP 179 N 1.29 2.14 0.21 5.22 -0.00 -1.26 -2.18 118.94 124.36 3itv s TRP 179 Ca -0.04 -1.01 0.08 0.00 -0.00 0.00 0.00 56.10 55.12 3itv s TRP 179 Cb -0.20 -1.51 -0.05 0.00 -0.00 0.00 0.00 33.47 31.71 3itv s TRP 179 CO -0.00 -0.49 -0.13 0.96 -0.00 0.00 0.00 176.95 177.28 3itv s ILE 180 N 0.89 1.73 -1.99 5.86 -4.36 -1.26 -4.70 121.20 117.37 3itv s ILE 180 Ca -0.08 -2.21 0.26 0.00 -0.26 0.00 0.00 60.65 58.37 3itv s ILE 180 Cb -0.15 -2.09 0.27 0.00 1.25 0.00 0.00 42.46 41.73 3itv s ILE 180 CO -0.01 -0.56 1.50 0.61 0.24 0.00 0.00 174.94 176.73 3itv n GLY 181 N -0.41 -0.32 3.19 6.27 0.00 -1.26 -4.95 105.19 107.72 3itv n GLY 181 Ca -0.08 -0.47 -0.55 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.30 0.31 0.00 1.61 9.92 -1.26 -4.08 116.55 122.75 3itv n ASP 182 Ca 0.13 1.04 0.00 0.00 -0.53 0.00 0.00 54.79 55.43 3itv n ASP 182 Cb 0.38 -0.81 0.00 0.00 -0.64 0.00 0.00 41.12 40.05 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 2.00 -0.54 3.10 0.44 0.00 -1.26 -1.69 105.19 107.25 3itv n GLY 183 Ca 0.21 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 45.31 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 0.76 0.00 1.61 1.04 0.57 -4.91 113.70 108.78 3itv s SER 184 Ca 0.00 -0.85 0.15 0.00 0.48 0.00 0.00 55.95 55.73 3itv s SER 184 Cb 0.00 0.12 -0.05 0.00 0.10 0.00 0.00 66.02 66.19 3itv s SER 184 CO 0.00 -0.43 0.75 0.59 0.98 0.00 0.00 173.24 175.13 3itv n ASN 185 N 0.52 1.30 -3.90 7.02 4.13 -1.26 -1.11 115.26 121.95 3itv n ASN 185 Ca -0.16 -1.15 -0.12 0.00 1.68 0.00 0.00 54.58 54.83 3itv n ASN 185 Cb 0.59 0.62 -0.13 0.00 -1.54 0.00 0.00 39.78 39.31 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 -1.94 0.10 0.33 3.10 0.40 -1.26 -4.38 117.98 114.33 3itv s PHE 186 Ca 0.10 -0.11 -0.29 0.00 -0.60 0.00 0.00 56.93 56.04 3itv s PHE 186 Cb 0.12 -0.07 -0.11 0.00 0.51 0.00 0.00 43.02 43.46 3itv s PHE 186 CO 0.43 -0.03 1.52 -2.30 0.70 0.00 0.00 175.22 175.54 3itv n PRO 187 N 2.79 2.63 0.00 0.24 -0.02 -1.26 -1.60 135.00 137.78 3itv n PRO 187 Ca -0.14 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 3itv n PRO 187 Cb 0.59 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 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 1.34 2.95 0.32 -1.23 0.00 -1.26 -4.87 105.19 102.44 3itv n GLY 188 Ca 0.05 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.13 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 0.76 0.73 -6.45 1.61 4.15 -1.73 -3.42 115.11 110.76 3itv h GLN 189 Ca 0.00 -0.04 -0.61 0.00 0.77 0.00 0.00 58.65 58.77 3itv h GLN 189 Cb 0.00 -0.16 -0.21 0.00 0.21 0.00 0.00 27.48 27.31 3itv h GLN 189 CO 0.00 0.48 -0.84 -1.12 -1.93 0.00 0.00 178.83 175.42 3itv s SER 190 N -5.54 2.91 -0.41 -0.69 0.01 -1.26 -5.09 113.70 103.63 3itv s SER 190 Ca -0.12 -0.74 -0.18 0.00 1.31 0.00 0.00 55.95 56.22 3itv s SER 190 Cb 0.21 -0.18 0.02 0.00 0.21 0.00 0.00 66.02 66.28 3itv s SER 190 CO 0.79 0.10 0.48 0.21 0.41 0.00 0.00 173.24 175.23 3itv s ASN 191 N -2.09 6.23 0.20 2.44 3.84 -1.26 -4.96 114.94 119.34 3itv s ASN 191 Ca 0.11 -0.51 -0.16 0.00 0.21 0.00 0.00 52.86 52.50 3itv s ASN 191 Cb -0.09 -2.25 0.20 0.00 -0.55 0.00 0.00 41.25 38.56 3itv s ASN 191 CO 0.06 -0.59 1.60 -0.26 -2.79 0.00 0.00 177.10 175.11 3itv h PHE 192 N 8.72 -0.62 -0.18 0.43 0.04 -1.98 -1.04 116.94 122.30 3itv h PHE 192 Ca -0.27 0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.53 3itv h PHE 192 Cb 1.11 0.37 -0.01 0.00 2.20 0.00 0.00 35.95 39.62 3itv h PHE 192 CO 0.66 -0.34 -0.03 1.15 -0.60 0.00 0.00 178.31 179.15 3itv h THR 193 N -0.08 1.28 -0.76 -1.55 2.02 -1.99 -2.14 112.91 109.69 3itv h THR 193 Ca 0.28 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.45 3itv h THR 193 Cb 0.52 1.56 -0.03 0.00 -1.74 0.00 0.00 68.15 68.46 3itv h THR 193 CO -0.69 0.30 0.34 0.03 0.37 0.00 0.00 175.52 175.86 3itv h ARG 194 N 0.07 1.10 -0.70 6.66 3.08 -1.91 0.55 114.38 123.23 3itv h ARG 194 Ca 0.05 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 59.87 3itv h ARG 194 Cb 0.46 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 3itv h ARG 194 CO 0.02 0.86 0.21 0.00 -1.07 0.00 0.00 179.97 179.99 3itv h ALA 195 N 1.28 0.91 -0.33 0.04 0.00 -1.16 -0.96 119.26 119.04 3itv h ALA 195 Ca 0.26 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 3itv h ALA 195 Cb 0.15 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3itv h ALA 195 CO -0.03 0.60 -0.30 0.35 0.00 0.00 0.00 179.25 179.87 3itv h PHE 196 N 1.03 0.82 -0.71 0.00 3.57 -0.87 -1.35 116.94 119.42 3itv h PHE 196 Ca 0.22 -0.21 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 3itv h PHE 196 Cb 0.32 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.84 3itv h PHE 196 CO 0.02 0.92 0.29 0.93 -2.23 0.00 0.00 178.31 178.25 3itv h GLU 197 N 0.60 1.06 -0.58 1.11 5.08 -0.52 0.01 114.58 121.35 3itv h GLU 197 Ca 0.07 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 3itv h GLU 197 Cb 0.81 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 3itv h GLU 197 CO 0.07 0.87 0.18 0.00 -1.00 0.00 0.00 179.01 179.13 3itv h ARG 198 N 1.02 0.90 -0.20 2.33 3.08 -0.93 -1.55 114.38 119.04 3itv h ARG 198 Ca 0.24 -0.20 0.01 0.00 0.07 0.00 0.00 59.98 60.10 3itv h ARG 198 Cb 0.21 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 3itv h ARG 198 CO -0.02 0.81 0.12 -0.92 -1.07 0.00 0.00 179.97 178.89 3itv h TYR 199 N 0.82 0.23 -0.93 3.04 5.03 -0.80 -1.45 116.97 122.90 3itv h TYR 199 Ca 0.19 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.51 3itv h TYR 199 Cb 0.29 -0.07 -0.05 0.00 1.55 0.00 0.00 36.73 38.45 3itv h TYR 199 CO 0.02 0.14 0.60 -0.07 -1.32 0.00 0.00 178.16 177.53 3itv h LEU 200 N 0.25 1.08 -0.57 2.82 3.38 -0.78 0.32 115.31 121.81 3itv h LEU 200 Ca 0.07 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 3itv h LEU 200 Cb -0.02 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 3itv h LEU 200 CO -0.03 0.80 0.01 0.28 0.09 0.00 0.00 178.44 179.59 3itv h SER 201 N 1.26 0.99 -0.42 -0.43 0.02 -1.02 -1.10 113.55 112.84 3itv h SER 201 Ca 0.34 -0.30 -0.12 0.00 -0.84 0.00 0.00 61.79 60.87 3itv h SER 201 Cb -0.12 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.15 3itv h SER 201 CO -0.07 1.05 -0.19 0.00 -1.14 0.00 0.00 176.83 176.48 3itv h ALA 202 N 0.97 0.59 0.00 3.77 0.00 -0.89 -2.74 119.26 120.97 3itv h ALA 202 Ca 0.16 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 3itv h ALA 202 Cb 0.54 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3itv h ALA 202 CO 0.03 0.55 -0.31 0.52 0.00 0.00 0.00 179.25 180.03 3itv h MET 203 N 0.70 0.00 -0.25 0.00 2.07 -0.82 -1.76 114.93 114.87 3itv h MET 203 Ca 0.10 0.00 -0.08 0.00 -2.07 0.00 0.00 59.70 57.64 3itv h MET 203 Cb 0.75 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.46 3itv h MET 203 CO 0.06 0.31 -0.20 0.00 1.07 0.00 0.00 176.91 178.15 3itv h ALA 204 N 1.69 1.19 -0.37 6.32 0.00 -0.95 0.19 119.26 127.33 3itv h ALA 204 Ca -0.00 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 3itv h ALA 204 Cb 0.57 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3itv h ALA 204 CO 0.04 0.52 -0.32 0.93 0.00 0.00 0.00 179.25 180.42 3itv h GLU 205 N 0.41 0.82 -0.33 0.00 4.39 -1.05 -0.22 114.58 118.60 3itv h GLU 205 Ca 0.07 -0.39 -0.06 0.00 0.34 0.00 0.00 59.36 59.32 3itv h GLU 205 Cb 0.58 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.21 3itv h GLU 205 CO 0.04 1.02 -0.04 0.82 -1.16 0.00 0.00 179.01 179.70 3itv h ILE 206 N 0.69 1.27 -0.93 3.13 1.08 -0.89 -2.69 117.51 119.18 3itv h ILE 206 Ca 0.07 -1.05 0.06 0.00 -0.39 0.00 0.00 64.86 63.55 3itv h ILE 206 Cb 0.87 1.29 -0.06 0.00 -3.07 0.00 0.00 36.82 35.85 3itv h ILE 206 CO 0.08 0.34 0.59 0.22 -0.69 0.00 0.00 178.15 178.69 3itv h TYR 207 N 0.40 1.10 -0.68 1.37 5.03 -0.42 -0.67 116.97 123.09 3itv h TYR 207 Ca 0.09 0.03 0.04 0.00 2.58 0.00 0.00 58.73 61.47 3itv h TYR 207 Cb 0.51 -0.36 -0.04 0.00 1.55 0.00 0.00 36.73 38.39 3itv h TYR 207 CO 0.04 0.57 0.45 0.87 -1.32 0.00 0.00 178.16 178.78 3itv h LYS 208 N 1.09 0.77 -0.42 1.82 1.57 -0.80 -1.36 116.57 119.25 3itv h LYS 208 Ca 0.40 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 3itv h LYS 208 Cb 0.14 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3itv h LYS 208 CO -0.16 0.51 0.00 0.41 -0.57 0.00 0.00 179.45 179.64 3itv n GLY 209 N -1.44 1.12 3.70 3.86 0.00 -0.35 -4.90 105.19 107.18 3itv n GLY 209 Ca 0.09 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 3itv n GLY 209 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3itv s LEU 210 N -1.15 4.29 0.73 0.99 2.96 -0.51 -5.02 118.68 120.96 3itv s LEU 210 Ca 0.33 1.36 -0.16 0.00 -0.22 0.00 0.00 54.13 55.44 3itv s LEU 210 Cb 0.17 -3.31 0.02 0.00 0.50 0.00 0.00 46.19 43.58 3itv s LEU 210 CO 0.24 -0.26 1.11 -2.65 -1.32 0.00 0.00 176.35 173.46 3itv n PRO 211 N 4.29 0.57 0.00 0.98 -0.02 -1.26 -4.87 135.00 134.69 3itv n PRO 211 Ca 0.03 0.26 0.10 0.00 -2.02 0.00 0.00 63.50 61.87 3itv n PRO 211 Cb 0.50 -2.35 0.60 0.00 -0.02 0.00 0.00 33.50 32.23 3itv n PRO 211 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3itv n ASP 212 N -2.15 0.00 -0.49 2.55 8.00 -1.26 -2.18 116.55 121.02 3itv n ASP 212 Ca 0.14 -1.02 0.06 0.00 0.71 0.00 0.00 54.79 54.68 3itv n ASP 212 Cb 0.49 0.00 0.16 0.00 -0.02 0.00 0.00 41.12 41.75 3itv n ASP 212 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3itv n ASP 213 N -0.88 2.95 -4.56 -2.24 5.75 -1.26 -5.02 116.55 111.29 3itv n ASP 213 Ca 0.15 -2.53 -0.25 0.00 -0.01 0.00 0.00 54.79 52.16 3itv n ASP 213 Cb 0.07 -0.32 -0.09 0.00 -1.03 0.00 0.00 41.12 39.74 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 -1.93 2.45 0.18 2.11 0.52 -0.92 -4.87 118.94 116.47 3itv s TRP 214 Ca 0.26 -0.39 0.11 0.00 0.02 0.00 0.00 56.10 56.10 3itv s TRP 214 Cb 0.20 -1.27 -0.04 0.00 -1.15 0.00 0.00 33.47 31.21 3itv s TRP 214 CO 0.08 0.60 -0.24 0.15 0.02 0.00 0.00 176.95 177.56 3itv s LYS 215 N -3.62 1.47 -0.20 4.98 1.02 -0.88 -4.88 119.74 117.63 3itv s LYS 215 Ca 0.32 -1.47 0.00 0.00 0.02 0.00 0.00 55.97 54.84 3itv s LYS 215 Cb -0.02 -1.81 0.02 0.00 -0.52 0.00 0.00 37.83 35.50 3itv s LYS 215 CO 0.17 0.40 -0.15 -1.17 -0.92 0.00 0.00 175.35 173.68 3itv s LEU 216 N -2.53 2.54 -0.16 3.17 2.96 0.17 -1.59 118.68 123.24 3itv s LEU 216 Ca 0.19 -0.74 -0.04 0.00 -0.22 0.00 0.00 54.13 53.32 3itv s LEU 216 Cb -0.08 -1.55 -0.03 0.00 0.50 0.00 0.00 46.19 45.03 3itv s LEU 216 CO 0.09 -0.04 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.69 3itv s PHE 217 N 1.30 3.06 -0.11 5.38 0.08 0.59 -0.88 117.98 127.39 3itv s PHE 217 Ca 0.03 -0.24 -0.02 0.00 0.12 0.00 0.00 56.93 56.82 3itv s PHE 217 Cb -0.15 -1.97 -0.03 0.00 -0.57 0.00 0.00 43.02 40.30 3itv s PHE 217 CO -0.10 -0.00 -0.03 -1.54 -0.10 0.00 0.00 175.22 173.46 3itv s SER 218 N 0.34 4.94 -0.23 1.36 1.04 -0.84 0.07 113.70 120.39 3itv s SER 218 Ca -0.03 0.00 -0.02 0.00 0.48 0.00 0.00 55.95 56.38 3itv s SER 218 Cb -0.14 -1.52 0.01 0.00 0.10 0.00 0.00 66.02 64.47 3itv s SER 218 CO 0.03 0.29 -0.07 -0.70 0.98 0.00 0.00 173.24 173.77 3itv s GLU 219 N -0.38 3.07 0.53 4.02 2.12 -0.93 -1.11 118.70 126.02 3itv s GLU 219 Ca 0.07 -0.82 -0.11 0.00 0.36 0.00 0.00 54.97 54.47 3itv s GLU 219 Cb -0.12 -2.94 -0.05 0.00 0.26 0.00 0.00 34.13 31.28 3itv s GLU 219 CO 0.02 -0.29 0.92 -3.38 -0.54 0.00 0.00 175.26 171.99 3itv s HIS 220 N 1.38 3.55 -0.26 5.30 -3.43 -1.25 -4.69 115.29 115.88 3itv s HIS 220 Ca 0.03 1.18 -0.14 0.00 -0.80 0.00 0.00 55.06 55.34 3itv s HIS 220 Cb -0.15 -2.60 0.09 0.00 -1.43 0.00 0.00 32.58 28.49 3itv s HIS 220 CO -0.05 -0.42 0.63 0.21 -2.00 0.00 0.00 174.74 173.11 3itv s LYS 221 N -4.59 0.63 0.20 -0.38 2.20 -0.18 -4.75 119.74 112.86 3itv s LYS 221 Ca 0.54 1.19 -0.11 0.00 -0.36 0.00 0.00 55.97 57.22 3itv s LYS 221 Cb -0.10 0.24 0.13 0.00 -1.51 0.00 0.00 37.83 36.58 3itv s LYS 221 CO 0.43 -0.16 1.86 1.98 -0.36 0.00 0.00 175.35 179.10 3itv h MET 222 N 7.23 0.90 -2.65 4.03 1.85 -1.09 -3.35 114.93 121.85 3itv h MET 222 Ca -0.29 -0.06 0.11 0.00 -0.61 0.00 0.00 59.70 58.86 3itv h MET 222 Cb 1.20 -0.20 -0.08 0.00 0.43 0.00 0.00 31.60 32.95 3itv h MET 222 CO 0.17 0.60 0.36 1.52 -0.40 0.00 0.00 176.91 179.17 3itv s TYR 223 N -6.12 -0.20 0.01 1.39 1.13 -1.26 -4.52 117.35 107.78 3itv s TYR 223 Ca -0.13 -0.14 0.00 0.00 -1.41 0.00 0.00 57.07 55.39 3itv s TYR 223 Cb 0.14 0.65 0.00 0.00 -1.10 0.00 0.00 41.96 41.65 3itv s TYR 223 CO 0.77 -0.97 0.00 -1.91 -2.51 0.00 0.00 175.55 170.93 3itv n GLU 224 N -0.44 -0.26 0.07 -3.49 2.13 -1.26 -4.82 120.64 112.56 3itv n GLU 224 Ca -0.06 0.66 0.10 0.00 0.66 0.00 0.00 57.16 58.53 3itv n GLU 224 Cb 0.60 -0.39 0.43 0.00 0.27 0.00 0.00 31.44 32.35 3itv n GLU 224 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3itv n PRO 225 N 0.09 0.12 -3.03 5.31 -0.04 -1.26 -4.97 135.00 131.22 3itv n PRO 225 Ca 0.00 0.32 -0.40 0.00 -0.04 0.00 0.00 63.50 63.38 3itv n PRO 225 Cb 0.00 -1.71 -0.05 0.00 -0.04 0.00 0.00 33.50 31.70 3itv n PRO 225 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3itv s ALA 226 N -3.17 3.33 -1.48 0.55 0.00 -1.26 -4.97 121.76 114.77 3itv s ALA 226 Ca 0.06 0.14 0.16 0.00 0.00 0.00 0.00 51.96 52.32 3itv s ALA 226 Cb 0.10 -2.97 0.39 0.00 0.00 0.00 0.00 23.12 20.64 3itv s ALA 226 CO 0.37 -0.12 1.31 1.19 0.00 0.00 0.00 175.76 178.51 3itv n PHE 227 N 3.82 0.56 0.04 0.00 3.72 -1.22 -4.56 117.46 119.82 3itv n PHE 227 Ca -0.01 -0.41 0.00 0.00 -0.05 0.00 0.00 57.45 56.98 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 0.98 -0.30 -4.04 1.38 9.36 -0.27 -4.93 117.16 119.34 3itv n TYR 228 Ca 0.16 0.05 -0.09 0.00 3.32 0.00 0.00 57.90 61.34 3itv n TYR 228 Cb 0.49 0.10 -0.11 0.00 -0.63 0.00 0.00 39.34 39.20 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 -5.50 0.46 -0.03 2.98 1.04 -0.45 -4.97 113.70 107.23 3itv s SER 229 Ca 0.00 -0.71 0.02 0.00 0.48 0.00 0.00 55.95 55.73 3itv s SER 229 Cb 0.00 0.13 0.01 0.00 0.10 0.00 0.00 66.02 66.26 3itv s SER 229 CO 0.00 -0.40 -0.07 -0.89 0.98 0.00 0.00 173.24 172.86 3itv s THR 230 N -2.46 0.65 0.10 2.02 2.01 -1.26 -0.31 115.64 116.39 3itv s THR 230 Ca -0.05 -0.25 -0.28 0.00 0.31 0.00 0.00 61.69 61.42 3itv s THR 230 Cb -0.03 -0.62 -0.10 0.00 0.01 0.00 0.00 72.50 71.76 3itv s THR 230 CO -0.04 0.23 1.64 0.58 -0.69 0.00 0.00 174.62 176.33 3itv h VAL 231 N 5.69 0.43 -3.27 3.82 2.07 -1.66 -3.05 116.25 120.29 3itv h VAL 231 Ca -0.35 0.00 -0.80 0.00 0.82 0.00 0.00 66.70 66.38 3itv h VAL 231 Cb 1.17 0.43 -0.28 0.00 -1.52 0.00 0.00 31.29 31.09 3itv h VAL 231 CO 0.48 0.00 0.56 0.52 0.02 0.00 0.00 177.57 179.15 3itv n VAL 232 N -5.38 4.81 0.03 2.57 0.31 -1.26 -4.83 118.33 114.58 3itv n VAL 232 Ca -0.08 -5.61 -0.07 0.00 -0.01 0.00 0.00 64.34 58.58 3itv n VAL 232 Cb 0.29 -2.36 -0.12 0.00 -0.91 0.00 0.00 33.84 30.73 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 6.09 0.00 0.00 5.55 -0.00 -1.66 -0.46 115.11 124.62 3itv h GLN 233 Ca 0.19 0.00 -0.25 0.00 -0.00 0.00 0.00 58.65 58.59 3itv h GLN 233 Cb 0.76 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 28.18 3itv h GLN 233 CO 1.14 0.80 -0.10 -0.40 -0.00 0.00 0.00 178.83 180.27 3itv n ASP 234 N -3.23 -1.43 0.26 0.06 5.68 -1.26 -2.18 116.55 114.44 3itv n ASP 234 Ca -0.06 -2.82 0.13 0.00 -0.50 0.00 0.00 54.79 51.54 3itv n ASP 234 Cb 0.97 2.61 0.69 0.00 -1.14 0.00 0.00 41.12 44.26 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 -0.05 2.11 5.08 -1.95 -1.47 115.95 121.65 3itv h TRP 235 Ca -0.27 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.69 3itv h TRP 235 Cb 1.17 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.32 3itv h TRP 235 CO 0.00 0.13 -0.01 0.78 -1.28 0.00 0.00 178.44 178.06 3itv h GLY 236 N 1.14 0.10 1.20 11.11 0.00 -1.99 0.14 103.07 114.78 3itv h GLY 236 Ca -0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 47.33 47.18 3itv h GLY 236 CO 0.02 0.08 0.14 -0.84 0.00 0.00 0.00 176.54 175.94 3itv h THR 237 N -0.25 1.25 -0.77 4.70 2.02 -1.90 -2.07 112.91 115.88 3itv h THR 237 Ca 0.01 -0.92 -0.00 0.00 0.77 0.00 0.00 66.41 66.27 3itv h THR 237 Cb 0.40 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.39 3itv h THR 237 CO 0.01 0.35 0.47 -1.13 0.37 0.00 0.00 175.52 175.59 3itv h ASN 238 N 0.94 0.91 -0.40 4.18 -0.00 -1.06 -1.05 115.58 119.10 3itv h ASN 238 Ca 0.20 -0.05 -0.01 0.00 -0.00 0.00 0.00 56.30 56.43 3itv h ASN 238 Cb 0.35 -0.23 -0.02 0.00 -0.00 0.00 0.00 38.32 38.42 3itv h ASN 238 CO 0.00 0.70 0.20 0.22 -0.00 0.00 0.00 177.43 178.55 3itv h TYR 239 N 1.05 0.58 -0.82 0.67 3.20 -0.29 -1.11 116.97 120.24 3itv h TYR 239 Ca 0.28 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.18 3itv h TYR 239 Cb -0.06 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 37.98 3itv h TYR 239 CO -0.01 0.47 0.53 -0.07 -1.64 0.00 0.00 178.16 177.45 3itv h LEU 240 N 0.51 0.80 0.41 2.82 3.38 -0.82 0.20 115.31 122.61 3itv h LEU 240 Ca 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 3itv h LEU 240 Cb 0.11 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3itv h LEU 240 CO -0.02 0.52 -0.20 0.40 0.09 0.00 0.00 178.44 179.23 3itv h ILE 241 N 0.91 0.53 -0.64 1.22 2.04 -0.62 -1.66 117.51 119.29 3itv h ILE 241 Ca 0.35 -0.45 0.04 0.00 1.00 0.00 0.00 64.86 65.79 3itv h ILE 241 Cb 0.20 0.73 -0.05 0.00 -0.74 0.00 0.00 36.82 36.96 3itv h ILE 241 CO -0.12 0.08 0.38 0.00 0.00 0.00 0.00 178.15 178.49 3itv h ALA 242 N -0.41 0.85 -0.75 1.87 0.00 -0.90 -0.61 119.26 119.31 3itv h ALA 242 Ca -0.06 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 3itv h ALA 242 Cb 0.55 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3itv h ALA 242 CO 0.09 0.10 0.24 0.37 0.00 0.00 0.00 179.25 180.06 3itv h GLN 243 N 0.73 1.16 -0.25 0.00 5.75 -1.00 -2.75 115.11 118.76 3itv h GLN 243 Ca 0.27 -0.25 -0.09 0.00 -0.15 0.00 0.00 58.65 58.43 3itv h GLN 243 Cb 0.08 -0.17 -0.00 0.00 1.07 0.00 0.00 27.48 28.46 3itv h GLN 243 CO -0.13 0.98 -0.21 1.15 -2.65 0.00 0.00 178.83 177.96 3itv h THR 244 N 1.11 1.31 -0.38 2.39 2.02 -0.77 -3.33 112.91 115.27 3itv h THR 244 Ca 0.24 -1.36 -0.06 0.00 0.77 0.00 0.00 66.41 66.00 3itv h THR 244 Cb 0.30 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 3itv h THR 244 CO -0.01 0.43 0.01 -0.07 0.37 0.00 0.00 175.52 176.25 3itv h LEU 245 N 0.29 0.65 0.00 2.58 3.38 -1.06 -3.50 115.31 117.65 3itv h LEU 245 Ca 0.04 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.71 3itv h LEU 245 Cb 0.76 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3itv h LEU 245 CO 0.05 0.79 0.00 0.61 0.09 0.00 0.00 178.44 179.99 3itv n GLY 246 N -0.38 1.81 0.31 0.83 0.00 -1.04 -4.92 105.19 101.80 3itv n GLY 246 Ca -0.01 -1.74 0.16 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.83 132.00 130.01 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 -3.83 0.26 -3.65 0.86 5.02 -1.26 -4.78 118.16 110.78 3itv n LYS 248 Ca -0.02 -0.06 -0.36 0.00 -2.02 0.00 0.00 58.31 55.85 3itv n LYS 248 Cb 0.14 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.57 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 -2.78 3.64 0.23 7.82 0.00 -0.69 -0.66 121.76 129.33 3itv s ALA 249 Ca 0.20 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 51.49 3itv s ALA 249 Cb 0.19 -2.28 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 3itv s ALA 249 CO 0.53 0.03 0.14 -0.65 0.00 0.00 0.00 175.76 175.81 3itv s GLN 250 N 0.61 1.32 -0.07 0.00 -0.21 -0.06 -4.73 119.66 116.53 3itv s GLN 250 Ca 0.10 -1.71 -0.11 0.00 0.02 0.00 0.00 55.36 53.66 3itv s GLN 250 Cb -0.12 0.14 -0.05 0.00 1.00 0.00 0.00 33.01 33.98 3itv s GLN 250 CO 0.01 -0.40 0.26 0.00 -2.12 0.00 0.00 175.29 173.04 3itv s LEU 252 N -1.04 3.08 -0.32 0.00 0.20 -0.26 0.14 118.68 120.47 3itv s LEU 252 Ca 0.19 -0.19 -0.08 0.00 0.69 0.00 0.00 54.13 54.74 3itv s LEU 252 Cb -0.14 -1.72 0.01 0.00 -0.43 0.00 0.00 46.19 43.91 3itv s LEU 252 CO 0.08 0.17 0.13 -0.69 -0.29 0.00 0.00 176.35 175.75 3itv s VAL 253 N 0.32 4.21 -0.29 1.68 1.01 -0.69 -3.97 120.40 122.68 3itv s VAL 253 Ca -0.06 -0.72 -0.11 0.00 0.00 0.00 0.00 61.98 61.09 3itv s VAL 253 Cb -0.15 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 3itv s VAL 253 CO 0.04 -0.02 0.19 -0.62 0.00 0.00 0.00 175.10 174.69 3itv s ASP 254 N 1.52 6.00 0.30 3.32 -1.08 -1.26 -1.58 116.67 123.89 3itv s ASP 254 Ca 0.02 -0.08 0.05 0.00 -0.52 0.00 0.00 52.55 52.02 3itv s ASP 254 Cb -0.18 -2.12 0.75 0.00 -1.46 0.00 0.00 42.92 39.92 3itv s ASP 254 CO 0.04 -0.08 1.71 -0.07 0.52 0.00 0.00 175.17 177.29 3itv h LEU 255 N 8.38 0.44 -0.80 -1.34 3.38 -1.77 -1.81 115.31 121.79 3itv h LEU 255 Ca -0.35 0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3itv h LEU 255 Cb 1.18 0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.03 3itv h LEU 255 CO 0.56 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.75 3itv n GLY 256 N -1.33 0.12 1.93 0.83 0.00 -1.26 -4.16 105.19 101.32 3itv n GLY 256 Ca 0.23 -0.20 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 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 0.05 2.26 -4.41 1.61 8.25 -0.68 -3.56 115.22 118.74 3itv n HIS 257 Ca 0.06 -0.99 -0.24 0.00 -0.26 0.00 0.00 57.72 56.29 3itv n HIS 257 Cb 0.20 -0.61 -0.09 0.00 1.12 0.00 0.00 29.99 30.60 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 -2.82 2.43 0.81 4.41 3.76 -1.26 -2.44 115.29 120.20 3itv s HIS 258 Ca 0.53 -0.29 -0.13 0.00 -0.15 0.00 0.00 55.06 55.02 3itv s HIS 258 Cb 0.42 -1.07 0.09 0.00 1.11 0.00 0.00 32.58 33.12 3itv s HIS 258 CO 0.14 0.67 1.18 0.00 -0.85 0.00 0.00 174.74 175.89 3itv s ALA 259 N -2.39 1.84 0.28 -1.40 0.00 -1.26 -4.89 121.76 113.94 3itv s ALA 259 Ca 0.30 0.76 -0.30 0.00 0.00 0.00 0.00 51.96 52.72 3itv s ALA 259 Cb -0.06 -3.46 -0.13 0.00 0.00 0.00 0.00 23.12 19.47 3itv s ALA 259 CO 0.16 -2.28 1.30 -2.30 0.00 0.00 0.00 175.76 172.65 3itv n PRO 260 N -3.40 1.95 -0.88 0.00 -0.02 -1.26 -2.23 135.00 129.17 3itv n PRO 260 Ca 0.13 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3itv n PRO 260 Cb 0.51 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 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 1.51 -2.33 -4.68 2.55 3.02 -1.26 -4.99 115.26 109.07 3itv n ASN 261 Ca 0.09 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.22 3itv n ASN 261 Cb 0.33 -1.66 0.00 0.00 -0.61 0.00 0.00 39.78 37.84 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 -2.25 2.27 -2.89 3.41 -1.04 -0.95 -4.89 114.28 107.94 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 0.13 -1.50 -0.03 0.00 -1.82 0.00 0.00 70.33 67.11 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 6.40 0.15 8.00 3.84 -1.26 -4.86 114.94 126.75 3itv s ASN 263 Ca 0.59 -1.52 -0.10 0.00 0.21 0.00 0.00 52.86 52.04 3itv s ASN 263 Cb -0.55 -2.41 -0.02 0.00 -0.55 0.00 0.00 41.25 37.72 3itv s ASN 263 CO 0.60 -1.26 1.48 0.40 -2.79 0.00 0.00 177.10 175.53 3itv h ILE 264 N 5.95 1.28 0.00 -5.21 2.04 -1.98 -3.02 117.51 116.56 3itv h ILE 264 Ca -0.06 -1.60 -0.00 0.00 1.00 0.00 0.00 64.86 64.20 3itv h ILE 264 Cb 1.05 1.45 -0.00 0.00 -0.74 0.00 0.00 36.82 38.57 3itv h ILE 264 CO 1.16 0.53 -0.01 1.05 0.00 0.00 0.00 178.15 180.87 3itv h GLU 265 N 0.72 0.00 -0.24 2.37 9.09 -1.90 -0.80 114.58 123.81 3itv h GLU 265 Ca 0.05 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.30 3itv h GLU 265 Cb 1.01 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.11 3itv h GLU 265 CO 0.10 0.01 -0.51 1.98 0.05 0.00 0.00 179.01 180.64 3itv h MET 266 N 0.00 0.68 -0.79 1.06 4.05 -1.92 -1.88 114.93 116.13 3itv h MET 266 Ca -0.00 -0.41 0.00 0.00 -0.28 0.00 0.00 59.70 59.01 3itv h MET 266 Cb 0.02 0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 30.82 3itv h MET 266 CO 0.00 1.03 0.51 0.82 0.23 0.00 0.00 176.91 179.50 3itv h ILE 267 N 0.53 1.21 -0.05 1.77 1.08 -1.15 -0.10 117.51 120.80 3itv h ILE 267 Ca 0.02 -0.41 0.01 0.00 -0.39 0.00 0.00 64.86 64.09 3itv h ILE 267 Cb 1.08 0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 3itv h ILE 267 CO 0.10 0.21 -0.03 0.58 -0.69 0.00 0.00 178.15 178.33 3itv h VAL 268 N 1.08 0.91 -0.80 1.67 2.07 -1.14 -1.33 116.25 118.71 3itv h VAL 268 Ca 0.29 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.85 3itv h VAL 268 Cb -0.10 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 30.53 3itv h VAL 268 CO -0.06 0.00 0.51 0.00 0.02 0.00 0.00 177.57 178.04 3itv h ALA 269 N 1.03 1.06 -0.25 1.67 0.00 -0.77 -1.63 119.26 120.37 3itv h ALA 269 Ca 0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3itv h ALA 269 Cb 0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3itv h ALA 269 CO -0.07 0.31 0.09 0.00 0.00 0.00 0.00 179.25 179.57 3itv h ARG 270 N 0.98 0.38 -0.42 0.00 2.47 -0.66 -1.50 114.38 115.63 3itv h ARG 270 Ca 0.32 -0.07 -0.05 0.00 -1.26 0.00 0.00 59.98 58.92 3itv h ARG 270 Cb 0.04 -0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 28.28 3itv h ARG 270 CO -0.12 0.44 0.03 -0.07 0.56 0.00 0.00 179.97 180.81 3itv h LEU 271 N 0.24 0.61 -0.33 3.04 3.38 -1.02 -2.37 115.31 118.86 3itv h LEU 271 Ca 0.08 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 3itv h LEU 271 Cb 0.21 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3itv h LEU 271 CO -0.00 0.66 0.00 0.40 0.09 0.00 0.00 178.44 179.59 3itv h ILE 272 N 0.62 1.26 -0.64 1.22 2.04 -1.09 0.12 117.51 121.03 3itv h ILE 272 Ca 0.13 -0.95 0.05 0.00 1.00 0.00 0.00 64.86 65.09 3itv h ILE 272 Cb 0.34 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.61 3itv h ILE 272 CO 0.01 0.31 0.43 -0.61 0.00 0.00 0.00 178.15 178.29 3itv h GLN 273 N 0.38 0.67 -0.61 2.37 4.15 -0.94 -1.78 115.11 119.35 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 0.44 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.98 3itv h GLN 273 CO 0.02 0.44 0.00 1.19 -1.93 0.00 0.00 178.83 178.55 3itv n PHE 274 N -4.47 1.81 -2.34 3.99 3.72 -0.92 -4.96 117.46 114.29 3itv n PHE 274 Ca 0.09 -0.68 -0.19 0.00 -0.05 0.00 0.00 57.45 56.61 3itv n PHE 274 Cb 0.19 -0.39 -0.01 0.00 -0.94 0.00 0.00 39.48 38.33 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 0.84 -0.32 0.12 1.37 0.00 -0.67 -4.90 105.19 101.62 3itv n GLY 275 Ca 0.27 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.39 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 -2.93 1.28 -2.95 1.61 4.76 0.33 -4.94 118.16 115.34 3itv n LYS 276 Ca -0.23 -2.61 -0.44 0.00 -2.87 0.00 0.00 58.31 52.17 3itv n LYS 276 Cb 0.67 -1.49 -0.04 0.00 -1.84 0.00 0.00 35.03 32.33 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 -2.86 4.77 0.08 -0.35 2.96 -1.19 -0.36 118.68 121.74 3itv s LEU 277 Ca 0.32 -1.21 -0.13 0.00 -0.22 0.00 0.00 54.13 52.88 3itv s LEU 277 Cb 0.28 -2.38 -0.21 0.00 0.50 0.00 0.00 46.19 44.39 3itv s LEU 277 CO 0.02 -1.31 1.22 1.23 -1.32 0.00 0.00 176.35 176.20 3itv h GLY 278 N 10.83 0.79 0.00 7.98 0.00 -0.59 -3.43 103.07 118.65 3itv h GLY 278 Ca -0.26 -1.32 0.00 0.00 0.00 0.00 0.00 47.33 45.75 3itv h GLY 278 CO 1.15 1.17 0.00 0.61 0.00 0.00 0.00 176.54 179.47 3itv n GLY 279 N 1.00 -1.29 3.30 4.60 0.00 -1.16 -1.08 105.19 110.55 3itv n GLY 279 Ca -0.10 -0.95 -0.17 0.00 0.00 0.00 0.00 46.02 44.80 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 1.51 -0.30 1.61 0.40 0.39 -1.70 117.98 116.90 3itv s PHE 280 Ca 0.00 -0.66 0.01 0.00 -0.60 0.00 0.00 56.93 55.68 3itv s PHE 280 Cb 0.00 -0.73 0.09 0.00 0.51 0.00 0.00 43.02 42.89 3itv s PHE 280 CO 0.00 0.23 0.05 -1.01 0.70 0.00 0.00 175.22 175.19 3itv s HIS 281 N -3.14 2.46 0.22 0.36 3.76 -0.61 -1.48 115.29 116.86 3itv s HIS 281 Ca 0.20 -2.11 -0.23 0.00 -0.15 0.00 0.00 55.06 52.78 3itv s HIS 281 Cb 0.01 -2.04 -0.08 0.00 1.11 0.00 0.00 32.58 31.57 3itv s HIS 281 CO 0.04 -0.87 0.78 -0.06 -0.85 0.00 0.00 174.74 173.78 3itv s PHE 282 N 1.36 3.75 0.00 1.40 0.08 0.13 -2.27 117.98 122.43 3itv s PHE 282 Ca 0.07 1.54 0.00 0.00 0.12 0.00 0.00 56.93 58.66 3itv s PHE 282 Cb -0.18 -2.72 0.00 0.00 -0.57 0.00 0.00 43.02 39.55 3itv s PHE 282 CO -0.16 0.38 0.00 0.27 -0.10 0.00 0.00 175.22 175.62 3itv n ASN 283 N 1.02 0.00 -4.36 1.36 2.04 -1.26 -1.00 115.26 113.06 3itv n ASN 283 Ca -0.03 0.00 -0.18 0.00 -0.44 0.00 0.00 54.58 53.93 3itv n ASN 283 Cb 0.50 0.00 -0.10 0.00 -2.53 0.00 0.00 39.78 37.65 3itv n ASN 283 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 3itv s ASP 284 N 0.00 1.95 0.08 0.53 -1.08 0.19 -4.59 116.67 113.75 3itv s ASP 284 Ca 0.00 -1.26 -0.26 0.00 -0.52 0.00 0.00 52.55 50.51 3itv s ASP 284 Cb 0.00 -0.01 0.08 0.00 -1.46 0.00 0.00 42.92 41.53 3itv s ASP 284 CO 0.00 -0.53 0.87 -0.94 0.52 0.00 0.00 175.17 175.09 3itv s SER 285 N -3.35 -0.32 0.00 -0.34 1.04 -1.26 -1.30 113.70 108.17 3itv s SER 285 Ca 0.31 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.57 3itv s SER 285 Cb 0.06 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.65 3itv s SER 285 CO 0.11 -0.80 0.00 1.17 0.98 0.00 0.00 173.24 174.70 3itv n LYS 286 N -0.35 2.15 0.01 4.02 4.81 -1.26 -4.77 118.16 122.78 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 -0.77 -0.01 0.00 0.02 0.00 0.00 35.03 34.89 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 -1.29 0.00 0.00 5.64 4.01 -1.26 -5.10 117.16 119.17 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 0.26 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 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 3.01 5.26 2.74 2.72 0.00 -1.26 -4.91 105.19 112.75 3itv n GLY 288 Ca -0.04 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.61 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 5.49 0.28 1.61 2.03 -1.23 -4.73 116.55 120.00 3itv n ASP 289 Ca 0.00 -3.03 0.16 0.00 0.52 0.00 0.00 54.79 52.44 3itv n ASP 289 Cb 0.00 -1.50 0.78 0.00 -0.72 0.00 0.00 41.12 39.68 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 5.58 0.00 -5.70 1.67 3.32 -1.84 -3.47 116.42 115.98 3itv h ASP 290 Ca 0.50 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 57.12 3itv h ASP 290 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 3itv h ASP 290 CO 1.67 0.06 -0.68 0.47 -1.72 0.00 0.00 179.24 179.04 3itv n ASP 291 N -3.27 -5.16 -4.91 6.45 8.00 -1.23 -4.83 116.55 111.60 3itv n ASP 291 Ca -0.01 -0.57 -0.27 0.00 0.71 0.00 0.00 54.79 54.65 3itv n ASP 291 Cb 0.26 -4.14 0.05 0.00 -0.02 0.00 0.00 41.12 37.27 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 -7.02 2.96 0.09 0.64 1.43 -0.42 -1.74 118.68 114.60 3itv s LEU 292 Ca 0.53 0.73 -0.35 0.00 -1.03 0.00 0.00 54.13 54.01 3itv s LEU 292 Cb -0.26 -3.46 -0.15 0.00 0.03 0.00 0.00 46.19 42.35 3itv s LEU 292 CO 0.66 -1.37 1.54 0.47 0.23 0.00 0.00 176.35 177.87 3itv n ASP 293 N -2.85 2.60 -4.63 2.29 9.92 -1.26 -0.64 116.55 121.98 3itv n ASP 293 Ca 0.06 1.08 -0.48 0.00 -0.53 0.00 0.00 54.79 54.93 3itv n ASP 293 Cb 0.59 -1.33 -0.04 0.00 -0.64 0.00 0.00 41.12 39.70 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 3.54 0.18 -0.71 2.24 0.00 -1.26 -1.61 120.51 122.87 3itv n ALA 294 Ca 0.19 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.08 3itv n ALA 294 Cb 0.25 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.52 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 2.48 0.88 0.21 0.00 0.00 -1.26 -4.75 105.19 102.75 3itv n GLY 295 Ca 0.15 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.32 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 -1.67 -3.26 119.26 119.95 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 -1.59 -0.89 0.00 0.00 0.00 179.25 176.77 3itv n ILE 297 N -2.82 0.58 -3.59 0.00 -0.00 -1.26 -4.92 119.36 107.34 3itv n ILE 297 Ca 0.02 -0.15 -0.27 0.00 -0.00 0.00 0.00 62.75 62.35 3itv n ILE 297 Cb 0.36 -1.64 -0.11 0.00 -0.00 0.00 0.00 39.64 38.25 3itv n ILE 297 CO 0.00 0.00 0.00 -1.61 -0.00 0.00 0.00 176.55 174.94 3itv s GLU 298 N -2.19 1.53 0.45 0.38 2.02 -1.26 -4.98 118.70 114.65 3itv s GLU 298 Ca -0.15 -2.61 0.16 0.00 0.02 0.00 0.00 54.97 52.39 3itv s GLU 298 Cb 0.06 -2.22 1.04 0.00 0.10 0.00 0.00 34.13 33.11 3itv s GLU 298 CO 0.18 -1.35 1.99 -1.00 0.02 0.00 0.00 175.26 175.11 3itv h PRO 299 N 5.54 0.00 -0.46 0.39 0.13 -1.91 -2.93 132.00 132.76 3itv h PRO 299 Ca 0.22 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.21 3itv h PRO 299 Cb 0.85 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 3itv h PRO 299 CO 0.51 0.19 -0.26 -0.92 -0.23 0.00 0.00 178.00 177.29 3itv h TYR 300 N 0.00 1.14 -0.91 1.56 3.20 -1.93 -2.32 116.97 117.70 3itv h TYR 300 Ca -0.00 -0.29 0.05 0.00 3.14 0.00 0.00 58.73 61.62 3itv h TYR 300 Cb 0.34 -0.26 -0.06 0.00 1.54 0.00 0.00 36.73 38.29 3itv h TYR 300 CO 0.00 1.12 0.59 -0.09 -1.64 0.00 0.00 178.16 178.14 3itv h ARG 301 N 0.83 1.08 -0.66 1.82 2.43 -1.95 0.12 114.38 118.04 3itv h ARG 301 Ca 0.10 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 3itv h ARG 301 Cb 0.84 -0.24 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 3itv h ARG 301 CO 0.07 0.71 0.29 1.25 -1.51 0.00 0.00 179.97 180.79 3itv h LEU 302 N 1.11 0.88 -0.66 3.80 5.85 -1.44 -1.28 115.31 123.56 3itv h LEU 302 Ca 0.38 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 3itv h LEU 302 Cb 0.07 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 3itv h LEU 302 CO -0.14 0.79 0.33 0.15 -0.34 0.00 0.00 178.44 179.23 3itv h PHE 303 N 0.92 0.94 -0.03 1.25 3.57 -0.69 -2.07 116.94 120.82 3itv h PHE 303 Ca 0.22 -0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 3itv h PHE 303 Cb 0.16 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 3itv h PHE 303 CO 0.01 0.69 -0.23 -0.07 -2.23 0.00 0.00 178.31 176.47 3itv h LEU 304 N 0.91 0.05 -0.23 0.59 3.38 -0.28 0.25 115.31 119.99 3itv h LEU 304 Ca 0.23 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.12 3itv h LEU 304 Cb 0.10 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3itv h LEU 304 CO -0.03 0.29 -0.13 0.58 0.09 0.00 0.00 178.44 179.24 3itv h VAL 305 N 0.05 1.31 0.00 1.22 2.07 -0.84 -2.81 116.25 117.24 3itv h VAL 305 Ca 0.01 -1.22 -0.06 0.00 0.82 0.00 0.00 66.70 66.24 3itv h VAL 305 Cb 0.45 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 3itv h VAL 305 CO 0.03 0.38 -0.31 -0.26 0.02 0.00 0.00 177.57 177.43 3itv h PHE 306 N 0.20 0.00 -0.56 1.57 0.04 -0.71 -2.00 116.94 115.48 3itv h PHE 306 Ca 0.05 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.80 3itv h PHE 306 Cb 0.64 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.76 3itv h PHE 306 CO 0.07 0.31 0.26 -0.97 -0.60 0.00 0.00 178.31 177.37 3itv h ASN 307 N 0.00 0.71 0.20 2.17 -1.24 -0.29 0.03 115.58 117.17 3itv h ASN 307 Ca -0.00 -0.07 -0.17 0.00 0.71 0.00 0.00 56.30 56.76 3itv h ASN 307 Cb 0.63 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 39.49 3itv h ASN 307 CO 0.04 0.62 -0.67 -0.33 -1.29 0.00 0.00 177.43 175.80 3itv h GLU 308 N 0.79 0.43 -0.41 6.67 4.39 -1.13 -1.01 114.58 124.31 3itv h GLU 308 Ca 0.20 -0.32 -0.09 0.00 0.34 0.00 0.00 59.36 59.48 3itv h GLU 308 Cb 0.10 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 3itv h GLU 308 CO -0.02 0.95 -0.11 -0.07 -1.16 0.00 0.00 179.01 178.60 3itv h LEU 309 N 0.31 0.81 -0.61 1.33 3.38 -0.96 -2.02 115.31 117.55 3itv h LEU 309 Ca -0.02 -0.36 -0.15 0.00 0.09 0.00 0.00 57.88 57.44 3itv h LEU 309 Cb 1.22 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 3itv h LEU 309 CO 0.12 0.99 -0.56 0.58 0.09 0.00 0.00 178.44 179.65 3itv h VAL 310 N 0.62 1.35 -0.36 1.22 2.07 -1.01 -2.92 116.25 117.21 3itv h VAL 310 Ca 0.10 -1.86 -0.06 0.00 0.82 0.00 0.00 66.70 65.71 3itv h VAL 310 Cb 0.64 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.25 3itv h VAL 310 CO 0.04 0.56 -0.04 -0.78 0.02 0.00 0.00 177.57 177.38 3itv h ASP 311 N 0.30 0.55 -0.83 0.57 3.58 -1.05 -1.72 116.42 117.82 3itv h ASP 311 Ca 0.00 -0.12 0.08 0.00 0.42 0.00 0.00 57.03 57.40 3itv h ASP 311 Cb 1.08 -0.15 -0.07 0.00 1.72 0.00 0.00 39.33 41.92 3itv h ASP 311 CO 0.10 0.65 0.49 0.00 -2.88 0.00 0.00 179.24 177.60 3itv h ALA 312 N 1.41 1.16 -0.25 -0.78 0.00 -1.17 0.24 119.26 119.88 3itv h ALA 312 Ca 0.11 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 3itv h ALA 312 Cb 0.41 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3itv h ALA 312 CO 0.02 0.18 -0.04 1.49 0.00 0.00 0.00 179.25 180.90 3itv h GLU 313 N 0.87 0.46 -0.31 0.00 4.81 -1.41 -1.51 114.58 117.50 3itv h GLU 313 Ca 0.38 -0.17 0.02 0.00 -0.13 0.00 0.00 59.36 59.46 3itv h GLU 313 Cb 0.25 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 3itv h GLU 313 CO -0.20 0.67 0.21 0.00 -0.73 0.00 0.00 179.01 178.95 3itv h ALA 314 N 0.78 1.86 0.00 2.92 0.00 -0.39 -0.92 119.26 123.51 3itv h ALA 314 Ca 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3itv h ALA 314 Cb 0.48 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3itv h ALA 314 CO 0.02 0.11 0.00 0.54 0.00 0.00 0.00 179.25 179.92 3itv n ARG 315 N -4.49 0.03 -0.71 0.00 1.74 0.74 -4.92 116.66 109.06 3itv n ARG 315 Ca 0.02 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 3itv n ARG 315 Cb 0.12 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 3itv n ARG 315 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3itv n GLY 316 N 1.42 0.63 3.74 -0.13 0.00 -0.35 -5.02 105.19 105.47 3itv n GLY 316 Ca 0.07 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.00 2.42 0.14 1.61 1.01 -0.58 -4.99 120.40 118.00 3itv s VAL 317 Ca 0.00 0.34 0.06 0.00 0.00 0.00 0.00 61.98 62.37 3itv s VAL 317 Cb 0.00 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 3itv s VAL 317 CO 0.00 0.04 0.04 -0.54 0.00 0.00 0.00 175.10 174.64 3itv s LYS 318 N 0.10 2.59 -1.21 2.72 -0.14 -1.26 -4.56 119.74 117.99 3itv s LYS 318 Ca 0.64 -0.94 0.00 0.00 -1.36 0.00 0.00 55.97 54.32 3itv s LYS 318 Cb -0.45 -2.51 0.00 0.00 -1.68 0.00 0.00 37.83 33.20 3itv s LYS 318 CO 0.41 0.50 0.00 0.41 -0.76 0.00 0.00 175.35 175.90 3itv n GLY 319 N 0.10 1.24 3.30 -3.33 0.00 -1.26 -4.98 105.19 100.26 3itv n GLY 319 Ca -0.10 -0.50 -0.44 0.00 0.00 0.00 0.00 46.02 44.98 3itv n GLY 319 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3itv s PHE 320 N -2.43 3.30 -0.45 1.61 5.36 -1.26 -4.94 117.98 119.17 3itv s PHE 320 Ca 0.00 -1.38 0.06 0.00 -0.96 0.00 0.00 56.93 54.65 3itv s PHE 320 Cb 0.00 -3.49 0.21 0.00 -0.34 0.00 0.00 43.02 39.40 3itv s PHE 320 CO 0.00 -0.95 0.48 0.72 -1.46 0.00 0.00 175.22 174.01 3itv n HIS 321 N 5.12 0.12 -1.81 10.12 8.25 -1.26 -5.08 115.22 130.68 3itv n HIS 321 Ca -0.12 -3.59 -0.39 0.00 -0.26 0.00 0.00 57.72 53.36 3itv n HIS 321 Cb 0.41 -0.17 0.03 0.00 1.12 0.00 0.00 29.99 31.38 3itv n HIS 321 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3itv s PRO 322 N -0.89 3.46 -0.13 -0.41 0.04 -1.26 -4.97 135.00 130.83 3itv s PRO 322 Ca 0.34 2.32 -0.26 0.00 0.04 0.00 0.00 61.00 63.44 3itv s PRO 322 Cb 0.10 -2.48 -0.02 0.00 0.04 0.00 0.00 34.50 32.15 3itv s PRO 322 CO -0.14 -0.96 0.85 0.00 0.04 0.00 0.00 177.00 176.79 3itv s ALA 323 N -1.26 3.45 -0.19 8.56 0.00 -0.24 -4.92 121.76 127.17 3itv s ALA 323 Ca 0.66 0.14 -0.08 0.00 0.00 0.00 0.00 51.96 52.67 3itv s ALA 323 Cb -0.42 -3.23 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 3itv s ALA 323 CO 0.52 -0.54 0.07 -1.01 0.00 0.00 0.00 175.76 174.80 3itv s HIS 324 N 1.87 3.26 -0.01 0.00 3.76 -1.26 -0.46 115.29 122.45 3itv s HIS 324 Ca 0.41 0.09 -0.06 0.00 -0.15 0.00 0.00 55.06 55.34 3itv s HIS 324 Cb -0.17 -2.10 0.00 0.00 1.11 0.00 0.00 32.58 31.42 3itv s HIS 324 CO 0.15 0.15 0.13 -1.64 -0.85 0.00 0.00 174.74 172.68 3itv s MET 325 N 0.43 0.39 -0.14 1.40 -1.94 -0.55 -0.95 119.30 117.94 3itv s MET 325 Ca 0.04 -0.25 -0.14 0.00 -1.71 0.00 0.00 55.69 53.63 3itv s MET 325 Cb -0.12 0.16 -0.05 0.00 2.01 0.00 0.00 34.83 36.83 3itv s MET 325 CO 0.00 -0.08 0.33 0.42 -0.01 0.00 0.00 175.02 175.68 3itv s ILE 326 N -0.99 5.27 -0.43 2.53 1.01 0.12 0.17 121.20 128.89 3itv s ILE 326 Ca -0.11 0.63 0.02 0.00 0.00 0.00 0.00 60.65 61.19 3itv s ILE 326 Cb -0.06 -3.66 0.13 0.00 0.01 0.00 0.00 42.46 38.88 3itv s ILE 326 CO 0.01 0.40 0.22 -0.62 0.00 0.00 0.00 174.94 174.95 3itv s ASP 327 N 0.36 3.76 0.16 3.58 -1.08 -0.17 -3.79 116.67 119.48 3itv s ASP 327 Ca 0.19 -2.58 0.02 0.00 -0.52 0.00 0.00 52.55 49.66 3itv s ASP 327 Cb -0.14 -1.09 -0.05 0.00 -1.46 0.00 0.00 42.92 40.19 3itv s ASP 327 CO 0.06 -0.28 -0.01 -1.10 0.52 0.00 0.00 175.17 174.35 3itv s GLN 328 N 0.40 1.05 -0.02 4.34 -0.21 -1.26 -4.52 119.66 119.44 3itv s GLN 328 Ca 0.17 -1.49 0.04 0.00 0.02 0.00 0.00 55.36 54.10 3itv s GLN 328 Cb -0.24 -0.26 -0.01 0.00 1.00 0.00 0.00 33.01 33.51 3itv s GLN 328 CO -0.01 -0.10 -0.14 0.15 -2.12 0.00 0.00 175.29 173.06 3itv s LYS 329 N -3.90 1.32 -0.34 2.91 3.01 -0.71 -4.49 119.74 117.54 3itv s LYS 329 Ca 0.21 -0.50 0.02 0.00 -1.01 0.00 0.00 55.97 54.69 3itv s LYS 329 Cb 0.06 -1.22 0.09 0.00 -1.01 0.00 0.00 37.83 35.75 3itv s LYS 329 CO 0.02 0.25 0.05 -1.01 0.51 0.00 0.00 175.35 175.18 3itv s HIS 330 N -0.12 3.65 -0.14 3.18 3.76 -1.26 -4.59 115.29 119.77 3itv s HIS 330 Ca 0.01 -2.76 0.19 0.00 -0.15 0.00 0.00 55.06 52.35 3itv s HIS 330 Cb -0.08 -2.81 -0.15 0.00 1.11 0.00 0.00 32.58 30.66 3itv s HIS 330 CO 0.00 -0.94 0.75 0.09 -0.85 0.00 0.00 174.74 173.79 3itv n ASN 331 N 4.35 0.67 -0.53 1.40 3.02 -1.26 -1.04 115.26 121.87 3itv n ASN 331 Ca -0.00 0.29 0.04 0.00 -0.03 0.00 0.00 54.58 54.88 3itv n ASN 331 Cb 0.42 0.52 0.07 0.00 -0.61 0.00 0.00 39.78 40.17 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 -2.76 0.79 -4.16 2.41 0.24 -1.26 -4.74 118.33 108.85 3itv n VAL 332 Ca -0.10 -1.15 -0.12 0.00 -2.04 0.00 0.00 64.34 60.93 3itv n VAL 332 Cb 0.79 0.28 -0.09 0.00 -1.47 0.00 0.00 33.84 33.35 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 -1.19 0.00 -0.28 3.34 -4.23 -1.26 -5.10 115.64 106.92 3itv s THR 333 Ca 0.18 -1.86 -0.29 0.00 -1.18 0.00 0.00 61.69 58.54 3itv s THR 333 Cb 0.18 -2.45 -0.01 0.00 1.34 0.00 0.00 72.50 71.57 3itv s THR 333 CO -0.02 0.00 1.39 -0.62 -0.54 0.00 0.00 174.62 174.82 3itv s ASP 334 N -3.15 6.58 0.35 3.99 -1.08 -1.26 -4.89 116.67 117.21 3itv s ASP 334 Ca 0.35 1.30 0.14 0.00 -0.52 0.00 0.00 52.55 53.82 3itv s ASP 334 Cb 0.05 -2.54 1.03 0.00 -1.46 0.00 0.00 42.92 40.00 3itv s ASP 334 CO 0.13 -1.14 1.71 -0.65 0.52 0.00 0.00 175.17 175.74 3itv h PRO 335 N 9.73 0.42 -0.39 4.34 0.11 -1.87 -0.54 132.00 143.81 3itv h PRO 335 Ca -0.28 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.74 3itv h PRO 335 Cb 1.11 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 3itv h PRO 335 CO 1.03 0.28 0.01 0.82 -0.21 0.00 0.00 178.00 179.93 3itv h ILE 336 N 0.44 1.26 -0.55 4.15 1.08 -1.87 -0.57 117.51 121.45 3itv h ILE 336 Ca 0.67 -0.97 -0.07 0.00 -0.39 0.00 0.00 64.86 64.10 3itv h ILE 336 Cb 1.50 1.12 -0.02 0.00 -3.07 0.00 0.00 36.82 36.36 3itv h ILE 336 CO -0.47 0.33 0.08 -0.33 -0.69 0.00 0.00 178.15 177.07 3itv h GLU 337 N 0.51 0.91 -0.46 2.37 5.08 -1.54 -0.83 114.58 120.62 3itv h GLU 337 Ca 0.11 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 3itv h GLU 337 Cb 0.45 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3itv h GLU 337 CO 0.02 0.88 0.17 0.77 -1.00 0.00 0.00 179.01 179.85 3itv h SER 338 N 0.80 0.65 -0.39 1.42 0.02 -1.17 -1.35 113.55 113.53 3itv h SER 338 Ca 0.17 -0.19 -0.07 0.00 -0.84 0.00 0.00 61.79 60.86 3itv h SER 338 Cb 0.42 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 3itv h SER 338 CO 0.01 0.66 0.02 -0.07 -1.14 0.00 0.00 176.83 176.31 3itv h LEU 339 N 0.60 0.72 0.37 5.07 3.38 -0.94 0.29 115.31 124.80 3itv h LEU 339 Ca 0.15 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3itv h LEU 339 Cb 0.23 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3itv h LEU 339 CO -0.01 0.78 -0.18 0.40 0.09 0.00 0.00 178.44 179.52 3itv h ILE 340 N 0.71 0.65 0.00 1.22 2.04 -0.83 -0.70 117.51 120.59 3itv h ILE 340 Ca 0.14 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.84 3itv h ILE 340 Cb 0.41 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 3itv h ILE 340 CO 0.01 0.02 -0.25 0.78 0.00 0.00 0.00 178.15 178.72 3itv h ASN 341 N -0.55 0.00 -0.16 1.72 2.35 -1.12 -1.69 115.58 116.13 3itv h ASN 341 Ca -0.05 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.52 3itv h ASN 341 Cb 0.42 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.79 3itv h ASN 341 CO 0.08 0.25 -0.60 0.28 -1.65 0.00 0.00 177.43 175.79 3itv h SER 342 N 0.00 0.81 -0.32 5.81 0.02 -0.76 -0.52 113.55 118.59 3itv h SER 342 Ca -0.00 -0.61 -0.07 0.00 -0.84 0.00 0.00 61.79 60.27 3itv h SER 342 Cb 0.67 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 3itv h SER 342 CO 0.03 1.28 -0.01 0.00 -1.14 0.00 0.00 176.83 176.99 3itv h ALA 343 N 0.55 1.20 -0.46 3.77 0.00 -0.89 -1.62 119.26 121.81 3itv h ALA 343 Ca -0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 3itv h ALA 343 Cb 1.22 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3itv h ALA 343 CO 0.13 0.53 0.10 -0.91 0.00 0.00 0.00 179.25 179.09 3itv h ASN 344 N 0.64 0.71 -0.38 0.00 -0.26 -1.16 -2.15 115.58 112.99 3itv h ASN 344 Ca 0.13 -0.24 -0.05 0.00 -0.56 0.00 0.00 56.30 55.57 3itv h ASN 344 Cb 0.42 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.47 3itv h ASN 344 CO 0.02 0.77 0.07 -0.08 -1.06 0.00 0.00 177.43 177.14 3itv h GLU 345 N 0.62 0.71 -0.40 0.81 4.57 -0.63 0.67 114.58 120.93 3itv h GLU 345 Ca 0.14 -0.15 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 3itv h GLU 345 Cb 0.34 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 3itv h GLU 345 CO 0.00 0.68 -0.07 0.82 -1.18 0.00 0.00 179.01 179.27 3itv h ILE 346 N 0.68 1.27 -0.11 2.32 2.04 -1.12 -1.52 117.51 121.07 3itv h ILE 346 Ca 0.15 -1.13 -0.08 0.00 1.00 0.00 0.00 64.86 64.79 3itv h ILE 346 Cb 0.33 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 3itv h ILE 346 CO 0.01 0.38 -0.29 0.03 0.00 0.00 0.00 178.15 178.27 3itv h ARG 347 N 0.57 0.21 -0.06 2.37 3.08 -0.94 -1.88 114.38 117.73 3itv h ARG 347 Ca 0.11 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 3itv h ARG 347 Cb 0.58 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.61 3itv h ARG 347 CO 0.03 0.49 0.02 -0.09 -1.07 0.00 0.00 179.97 179.36 3itv h ARG 348 N 0.19 0.08 -0.71 0.04 2.43 -0.46 0.59 114.38 116.54 3itv h ARG 348 Ca 0.03 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 3itv h ARG 348 Cb 0.62 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 3itv h ARG 348 CO 0.05 0.20 0.27 0.00 -1.51 0.00 0.00 179.97 178.97 3itv h ALA 349 N 0.88 1.13 -0.09 2.80 0.00 -1.16 -1.24 119.26 121.59 3itv h ALA 349 Ca 0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3itv h ALA 349 Cb 0.14 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3itv h ALA 349 CO -0.00 0.62 0.03 -0.92 0.00 0.00 0.00 179.25 178.98 3itv h TYR 350 N 1.04 0.14 -0.53 0.00 3.20 -1.12 -0.94 116.97 118.76 3itv h TYR 350 Ca 0.24 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.14 3itv h TYR 350 Cb 0.23 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.41 3itv h TYR 350 CO 0.02 0.27 0.29 0.00 -1.64 0.00 0.00 178.16 177.09 3itv h ALA 351 N 0.86 0.69 -0.78 1.82 0.00 -0.63 -1.25 119.26 119.96 3itv h ALA 351 Ca 0.03 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3itv h ALA 351 Cb 0.19 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3itv h ALA 351 CO -0.00 -0.04 0.35 1.96 0.00 0.00 0.00 179.25 181.52 3itv h GLN 352 N 0.55 1.15 -0.29 0.00 4.20 -1.11 -1.84 115.11 117.77 3itv h GLN 352 Ca 0.23 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 3itv h GLN 352 Cb 0.11 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 3itv h GLN 352 CO -0.15 0.91 0.09 0.00 -0.67 0.00 0.00 178.83 179.01 3itv h ALA 353 N 1.18 1.62 0.00 3.87 0.00 -0.41 -1.17 119.26 124.35 3itv h ALA 353 Ca 0.27 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3itv h ALA 353 Cb 0.16 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3itv h ALA 353 CO -0.03 0.30 -0.12 -0.07 0.00 0.00 0.00 179.25 179.33 3itv h LEU 354 N 0.41 0.00 0.00 0.00 3.38 -0.41 -2.93 115.31 115.76 3itv h LEU 354 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 3itv h LEU 354 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3itv h LEU 354 CO -0.01 0.12 -0.09 0.18 0.09 0.00 0.00 178.44 178.74 3itv n LEU 355 N -3.32 0.78 -4.70 1.67 4.77 -0.45 -4.87 117.00 110.89 3itv n LEU 355 Ca -0.00 0.52 -0.43 0.00 -0.03 0.00 0.00 56.01 56.07 3itv n LEU 355 Cb 0.34 -0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 3itv n LEU 355 CO 0.30 -0.16 1.32 0.52 -1.33 0.00 0.00 177.39 178.04 3itv n VAL 356 N -2.22 0.03 -2.51 4.08 0.31 -1.11 -4.81 118.33 112.10 3itv n VAL 356 Ca 0.05 -0.01 -0.40 0.00 -0.01 0.00 0.00 64.34 63.97 3itv n VAL 356 Cb 0.43 -1.85 -0.03 0.00 -0.91 0.00 0.00 33.84 31.48 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 1.22 6.22 0.33 4.52 -1.08 -1.26 -4.86 116.67 121.76 3itv s ASP 357 Ca 0.77 -0.82 0.01 0.00 -0.52 0.00 0.00 52.55 52.00 3itv s ASP 357 Cb -0.56 -2.56 0.57 0.00 -1.46 0.00 0.00 42.92 38.91 3itv s ASP 357 CO 0.35 -1.77 1.95 0.03 0.52 0.00 0.00 175.17 176.25 3itv h ARG 358 N 10.21 0.81 -0.31 4.34 2.47 -1.95 -0.44 114.38 129.50 3itv h ARG 358 Ca -0.08 -0.09 -0.08 0.00 -1.26 0.00 0.00 59.98 58.48 3itv h ARG 358 Cb 1.04 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 29.19 3itv h ARG 358 CO 1.33 0.60 -0.12 0.00 0.56 0.00 0.00 179.97 182.35 3itv h ALA 359 N 1.53 0.43 -0.38 0.04 0.00 -1.99 -0.53 119.26 118.36 3itv h ALA 359 Ca 0.21 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3itv h ALA 359 Cb 0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3itv h ALA 359 CO -0.03 0.30 0.08 0.00 0.00 0.00 0.00 179.25 179.60 3itv h ALA 360 N 0.78 0.50 -0.42 0.00 0.00 -1.91 -1.93 119.26 116.28 3itv h ALA 360 Ca 0.07 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3itv h ALA 360 Cb 0.63 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3itv h ALA 360 CO 0.04 0.20 0.28 1.25 0.00 0.00 0.00 179.25 181.01 3itv h LEU 361 N 0.47 0.49 -1.11 0.00 5.85 -0.99 -1.65 115.31 118.37 3itv h LEU 361 Ca 0.12 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.84 3itv h LEU 361 Cb 0.34 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 3itv h LEU 361 CO 0.00 0.36 0.60 0.28 -0.34 0.00 0.00 178.44 179.35 3itv h SER 362 N 0.57 1.01 -0.42 1.25 0.02 -0.96 -0.39 113.55 114.63 3itv h SER 362 Ca 0.15 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.05 3itv h SER 362 Cb -0.06 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.22 3itv h SER 362 CO -0.03 0.71 0.11 1.23 -1.14 0.00 0.00 176.83 177.70 3itv h GLY 363 N 1.18 0.72 2.00 -3.77 0.00 -0.76 -1.29 103.07 101.16 3itv h GLY 363 Ca 0.35 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 47.14 3itv h GLY 363 CO -0.09 0.42 -0.43 -0.97 0.00 0.00 0.00 176.54 175.47 3itv h TYR 364 N 0.54 0.00 -0.11 5.60 0.05 -0.83 -1.88 116.97 120.34 3itv h TYR 364 Ca 0.13 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.84 3itv h TYR 364 Cb 0.31 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.05 3itv h TYR 364 CO 0.02 0.43 -0.23 1.96 -1.05 0.00 0.00 178.16 179.29 3itv h GLN 365 N 0.00 0.35 -0.36 4.88 4.20 -0.84 0.38 115.11 123.71 3itv h GLN 365 Ca -0.00 -0.23 -0.05 0.00 0.06 0.00 0.00 58.65 58.42 3itv h GLN 365 Cb 0.85 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.65 3itv h GLN 365 CO 0.06 0.83 0.00 0.93 -0.67 0.00 0.00 178.83 179.98 3itv h GLU 366 N -0.09 0.57 -0.09 1.46 4.39 -1.13 -2.37 114.58 117.31 3itv h GLU 366 Ca 0.00 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.58 3itv h GLU 366 Cb 0.83 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.40 3itv h GLU 366 CO 0.05 0.59 0.00 -0.25 -1.16 0.00 0.00 179.01 178.25 3itv n ASP 367 N -4.27 1.35 -3.66 1.42 10.43 -0.72 -4.93 116.55 116.17 3itv n ASP 367 Ca 0.02 -1.56 -0.27 0.00 2.57 0.00 0.00 54.79 55.55 3itv n ASP 367 Cb 0.25 -0.05 0.04 0.00 1.84 0.00 0.00 41.12 43.20 3itv n ASP 367 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3itv n ASN 368 N 0.08 -5.41 -4.38 -2.24 4.13 -0.72 -4.90 115.26 101.83 3itv n ASN 368 Ca 0.17 -0.61 -0.45 0.00 1.68 0.00 0.00 54.58 55.38 3itv n ASN 368 Cb 0.30 -4.31 0.00 0.00 -1.54 0.00 0.00 39.78 34.23 3itv n ASN 368 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 3itv n ASP 369 N -2.81 5.42 -0.33 6.41 -0.08 0.04 -4.87 116.55 120.33 3itv n ASP 369 Ca 0.01 -3.02 0.02 0.00 -1.51 0.00 0.00 54.79 50.29 3itv n ASP 369 Cb 0.55 -1.45 0.16 0.00 2.34 0.00 0.00 41.12 42.71 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 6.81 1.27 -0.17 -1.67 0.00 -1.91 -0.82 119.26 122.76 3itv h ALA 370 Ca 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3itv h ALA 370 Cb 0.86 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3itv h ALA 370 CO 1.12 0.32 0.05 1.25 0.00 0.00 0.00 179.25 182.00 3itv h LEU 371 N 1.04 0.26 -0.93 0.00 6.46 -1.96 -1.18 115.31 119.00 3itv h LEU 371 Ca 0.40 -0.21 -0.11 0.00 -0.12 0.00 0.00 57.88 57.85 3itv h LEU 371 Cb 0.19 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.04 3itv h LEU 371 CO -0.18 0.40 -0.51 0.24 -0.62 0.00 0.00 178.44 177.77 3itv h MET 372 N 0.10 0.00 -0.11 1.25 2.86 -1.92 -0.98 114.93 116.14 3itv h MET 372 Ca 0.06 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 3itv h MET 372 Cb 0.23 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.89 3itv h MET 372 CO -0.00 0.51 0.02 0.00 1.06 0.00 0.00 176.91 178.50 3itv h ALA 373 N 1.49 0.14 -0.26 6.32 0.00 -0.94 0.20 119.26 126.21 3itv h ALA 373 Ca -0.01 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 3itv h ALA 373 Cb 0.95 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 3itv h ALA 373 CO 0.07 -0.22 -0.30 0.00 0.00 0.00 0.00 179.25 178.80 3itv h THR 374 N -0.04 1.28 0.00 0.00 1.03 -1.10 -2.37 112.91 111.71 3itv h THR 374 Ca 0.03 -1.37 -0.07 0.00 -0.01 0.00 0.00 66.41 64.99 3itv h THR 374 Cb 0.27 1.40 -0.01 0.00 -1.07 0.00 0.00 68.15 68.74 3itv h THR 374 CO 0.00 0.44 -0.32 -0.08 -0.01 0.00 0.00 175.52 175.55 3itv h GLU 375 N 0.46 0.00 -0.45 0.00 4.57 -0.99 -1.17 114.58 117.00 3itv h GLU 375 Ca 0.06 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.12 3itv h GLU 375 Cb 0.75 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.32 3itv h GLU 375 CO 0.06 0.32 -0.21 1.15 -1.18 0.00 0.00 179.01 179.15 3itv h THR 376 N 0.00 1.27 -0.31 0.32 2.02 -0.43 0.55 112.91 116.33 3itv h THR 376 Ca -0.00 -1.35 -0.11 0.00 0.77 0.00 0.00 66.41 65.71 3itv h THR 376 Cb 0.62 1.15 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 3itv h THR 376 CO 0.04 0.46 -0.25 -0.07 0.37 0.00 0.00 175.52 176.07 3itv h LEU 377 N 0.78 0.76 -1.34 2.58 3.38 -1.20 -3.14 115.31 117.13 3itv h LEU 377 Ca 0.11 -0.45 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 3itv h LEU 377 Cb 0.75 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 3itv h LEU 377 CO 0.06 1.05 0.05 0.11 0.09 0.00 0.00 178.44 179.80 3itv h LYS 378 N 0.48 0.49 -0.15 1.13 1.79 -0.96 -1.00 116.57 118.35 3itv h LYS 378 Ca 0.06 -0.09 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 3itv h LYS 378 Cb 0.81 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.37 3itv h LYS 378 CO 0.06 0.48 0.05 0.00 -1.08 0.00 0.00 179.45 178.97 3itv h ARG 379 N 0.48 0.20 0.01 3.15 3.08 -0.84 0.30 114.38 120.77 3itv h ARG 379 Ca 0.11 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 3itv h ARG 379 Cb 0.24 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 3itv h ARG 379 CO 0.00 0.18 -0.19 0.00 -1.07 0.00 0.00 179.97 178.89 3itv h ALA 380 N 1.85 0.01 -0.67 0.04 0.00 -1.41 -3.30 119.26 115.78 3itv h ALA 380 Ca 0.05 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3itv h ALA 380 Cb 0.06 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3itv h ALA 380 CO -0.00 0.10 0.43 -0.92 0.00 0.00 0.00 179.25 178.86 3itv h TYR 381 N -0.93 0.85 0.00 0.00 3.20 -0.88 -2.01 116.97 117.19 3itv h TYR 381 Ca -0.04 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.84 3itv h TYR 381 Cb 1.09 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 39.08 3itv h TYR 381 CO 0.26 0.54 0.00 0.00 -1.64 0.00 0.00 178.16 177.32 3itv h ARG 382 N 0.91 0.00 -6.41 1.82 3.08 -0.54 -3.44 114.38 109.80 3itv h ARG 382 Ca 0.24 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.75 3itv h ARG 382 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.97 3itv h ARG 382 CO -0.05 0.00 0.84 0.99 -1.07 0.00 0.00 179.97 180.68 3itv s THR 383 N -3.30 3.56 -0.71 2.04 2.01 -0.76 -4.94 115.64 113.55 3itv s THR 383 Ca 0.05 0.98 -0.27 0.00 0.31 0.00 0.00 61.69 62.76 3itv s THR 383 Cb 0.10 -3.63 0.03 0.00 0.01 0.00 0.00 72.50 69.01 3itv s THR 383 CO 0.46 0.01 1.26 -0.62 -0.69 0.00 0.00 174.62 175.04 3itv s ASP 384 N 1.87 6.22 -0.00 3.53 2.15 -1.26 -4.85 116.67 124.32 3itv s ASP 384 Ca 0.65 -0.33 0.12 0.00 0.43 0.00 0.00 52.55 53.42 3itv s ASP 384 Cb -0.33 -2.56 0.34 0.00 -0.30 0.00 0.00 42.92 40.07 3itv s ASP 384 CO 0.28 -1.77 1.28 1.33 -0.17 0.00 0.00 175.17 176.12 3itv n VAL 385 N 6.45 0.53 -0.35 1.11 0.24 -1.26 -4.41 118.33 120.65 3itv n VAL 385 Ca 0.04 -0.51 0.10 0.00 -2.04 0.00 0.00 64.34 61.93 3itv n VAL 385 Cb 0.49 0.24 0.29 0.00 -1.47 0.00 0.00 33.84 33.39 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 2.21 0.83 -0.59 7.34 4.57 -1.98 -0.49 114.58 126.48 3itv h GLU 386 Ca 0.00 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 3itv h GLU 386 Cb 0.53 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.90 3itv h GLU 386 CO 0.01 0.55 0.35 -1.35 -1.18 0.00 0.00 179.01 177.39 3itv h PRO 387 N 0.86 0.79 -0.32 0.92 0.11 -1.92 0.79 132.00 133.23 3itv h PRO 387 Ca 0.52 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.48 3itv h PRO 387 Cb 0.69 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 3itv h PRO 387 CO -0.30 0.56 -0.12 0.82 -0.21 0.00 0.00 178.00 178.75 3itv h ILE 388 N 0.81 1.29 -0.51 4.15 2.04 -1.44 -0.47 117.51 123.37 3itv h ILE 388 Ca 0.21 -1.21 -0.03 0.00 1.00 0.00 0.00 64.86 64.83 3itv h ILE 388 Cb -0.02 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 3itv h ILE 388 CO -0.04 0.39 0.19 -0.07 0.00 0.00 0.00 178.15 178.62 3itv h LEU 389 N 0.41 0.71 -0.45 1.44 3.38 -0.86 -0.42 115.31 119.52 3itv h LEU 389 Ca 0.07 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 3itv h LEU 389 Cb 0.64 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 3itv h LEU 389 CO 0.04 0.70 -0.00 0.00 0.09 0.00 0.00 178.44 179.27 3itv h ALA 390 N 1.04 0.61 -0.34 1.53 0.00 -0.79 -1.88 119.26 119.42 3itv h ALA 390 Ca 0.17 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 3itv h ALA 390 Cb 0.22 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3itv h ALA 390 CO -0.01 0.41 -0.29 1.49 0.00 0.00 0.00 179.25 180.84 3itv h GLU 391 N 0.65 0.72 -0.47 0.00 4.57 -0.99 -0.17 114.58 118.89 3itv h GLU 391 Ca 0.13 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 57.99 3itv h GLU 391 Cb 0.50 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 3itv h GLU 391 CO 0.02 0.92 0.30 0.00 -1.18 0.00 0.00 179.01 179.07 3itv h ALA 392 N 1.06 0.60 -0.06 2.92 0.00 -0.93 -0.03 119.26 122.80 3itv h ALA 392 Ca 0.07 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3itv h ALA 392 Cb 0.80 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3itv h ALA 392 CO 0.07 0.06 0.02 0.00 0.00 0.00 0.00 179.25 179.40 3itv h ARG 393 N 0.63 0.10 -0.67 0.00 3.08 -1.07 -2.65 114.38 113.80 3itv h ARG 393 Ca 0.17 -0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.27 3itv h ARG 393 Cb -0.04 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 29.93 3itv h ARG 393 CO -0.03 0.27 0.34 -0.09 -1.07 0.00 0.00 179.97 179.38 3itv h ARG 394 N -0.09 0.59 0.00 0.04 2.43 -0.75 0.39 114.38 116.99 3itv h ARG 394 Ca 0.02 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 3itv h ARG 394 Cb 0.21 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 3itv h ARG 394 CO -0.00 0.39 -0.06 0.00 -1.51 0.00 0.00 179.97 178.79 3itv h ARG 395 N 0.61 0.00 -0.30 0.20 3.08 -0.92 -3.18 114.38 113.86 3itv h ARG 395 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 3itv h ARG 395 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 3itv h ARG 395 CO -0.23 0.06 0.00 0.25 -1.07 0.00 0.00 179.97 178.98 3itv n THR 396 N -3.22 2.02 -0.27 2.04 -2.24 -0.78 -4.95 114.28 106.88 3itv n THR 396 Ca -0.00 -1.65 0.00 0.00 -2.27 0.00 0.00 64.05 60.12 3itv n THR 396 Cb 0.29 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 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 -0.20 0.72 0.00 3.38 0.00 -1.06 -4.98 105.19 103.04 3itv n GLY 397 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.10 0.95 3.66 -0.02 0.00 0.13 -4.81 105.19 103.01 3itv n GLY 398 Ca 0.00 -1.95 -0.34 0.00 0.00 0.00 0.00 46.02 43.73 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 -2.66 3.22 0.20 4.61 0.00 -0.29 -4.24 121.76 122.60 3itv s ALA 399 Ca 0.00 -0.86 -0.11 0.00 0.00 0.00 0.00 51.96 50.99 3itv s ALA 399 Cb 0.00 -1.39 0.17 0.00 0.00 0.00 0.00 23.12 21.90 3itv s ALA 399 CO 0.00 0.60 1.82 0.28 0.00 0.00 0.00 175.76 178.46 3itv h VAL 400 N 4.00 1.03 -3.11 0.00 2.07 -1.88 -3.31 116.25 115.05 3itv h VAL 400 Ca -0.50 -0.24 -0.62 0.00 0.82 0.00 0.00 66.70 66.17 3itv h VAL 400 Cb 1.18 0.28 -0.40 0.00 -1.52 0.00 0.00 31.29 30.83 3itv h VAL 400 CO 0.55 0.13 -0.71 -0.62 0.02 0.00 0.00 177.57 176.93 3itv s ASP 401 N -5.62 3.86 0.15 0.57 -1.08 -1.26 -4.67 116.67 108.62 3itv s ASP 401 Ca -0.13 -2.68 -0.28 0.00 -0.52 0.00 0.00 52.55 48.95 3itv s ASP 401 Cb 0.15 -1.20 -0.02 0.00 -1.46 0.00 0.00 42.92 40.39 3itv s ASP 401 CO 0.75 -0.27 1.57 -0.65 0.52 0.00 0.00 175.17 177.10 3itv h PRO 402 N 6.74 -0.35 -0.56 4.34 0.11 -1.85 -1.06 132.00 139.37 3itv h PRO 402 Ca -0.03 0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.06 3itv h PRO 402 Cb 0.92 0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.09 3itv h PRO 402 CO 0.54 -0.23 0.17 0.28 -0.21 0.00 0.00 178.00 178.54 3itv h VAL 403 N -0.36 1.22 -0.59 3.15 2.07 -1.95 0.77 116.25 120.56 3itv h VAL 403 Ca 0.12 -0.76 -0.03 0.00 0.82 0.00 0.00 66.70 66.86 3itv h VAL 403 Cb 0.59 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 3itv h VAL 403 CO -0.55 0.29 0.26 0.00 0.02 0.00 0.00 177.57 177.59 3itv h ALA 404 N 1.37 0.77 -0.51 1.67 0.00 -1.88 -0.55 119.26 120.13 3itv h ALA 404 Ca 0.19 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 3itv h ALA 404 Cb 0.25 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3itv h ALA 404 CO -0.01 0.36 -0.17 1.15 0.00 0.00 0.00 179.25 180.58 3itv h THR 405 N 0.82 1.27 -0.45 0.00 2.02 -0.81 -0.99 112.91 114.77 3itv h THR 405 Ca 0.20 -1.33 0.03 0.00 0.77 0.00 0.00 66.41 66.08 3itv h THR 405 Cb 0.16 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 3itv h THR 405 CO -0.02 0.46 0.24 0.22 0.37 0.00 0.00 175.52 176.79 3itv h TYR 406 N 0.87 0.44 -0.35 3.16 3.20 -0.45 -0.64 116.97 123.21 3itv h TYR 406 Ca 0.12 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.87 3itv h TYR 406 Cb 0.74 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.87 3itv h TYR 406 CO 0.05 0.24 -0.35 0.00 -1.64 0.00 0.00 178.16 176.46 3itv h ARG 407 N 0.48 0.81 -0.08 1.82 3.08 -0.96 -2.89 114.38 116.64 3itv h ARG 407 Ca 0.19 -0.40 -0.04 0.00 0.07 0.00 0.00 59.98 59.80 3itv h ARG 407 Cb 0.07 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 3itv h ARG 407 CO -0.12 1.03 -0.14 0.00 -1.07 0.00 0.00 179.97 179.68 3itv h ALA 408 N 0.93 1.64 0.00 0.04 0.00 -0.73 -2.20 119.26 118.94 3itv h ALA 408 Ca 0.07 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3itv h ALA 408 Cb 0.90 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3itv h ALA 408 CO 0.08 0.27 -0.20 0.66 0.00 0.00 0.00 179.25 180.06 3itv h SER 409 N 0.11 0.00 -0.90 0.00 4.64 -0.92 -3.47 113.55 113.01 3itv h SER 409 Ca 0.02 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.13 3itv h SER 409 Cb 0.31 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.35 3itv h SER 409 CO 0.02 0.20 -0.22 0.61 -0.87 0.00 0.00 176.83 176.57 3itv n GLY 410 N 0.43 0.66 0.23 -0.77 0.00 -0.83 -4.93 105.19 99.98 3itv n GLY 410 Ca 0.01 -0.51 -0.02 0.00 0.00 0.00 0.00 46.02 45.50 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 0.49 -0.74 1.61 5.03 -1.84 -0.77 116.97 120.75 3itv h TYR 411 Ca -0.23 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.11 3itv h TYR 411 Cb 0.89 -0.13 -0.04 0.00 1.55 0.00 0.00 36.73 39.00 3itv h TYR 411 CO 0.28 0.20 0.47 -0.09 -1.32 0.00 0.00 178.16 177.70 3itv h ARG 412 N 0.51 0.99 -0.26 1.82 9.65 -1.92 -0.06 114.38 125.11 3itv h ARG 412 Ca 0.27 -0.07 -0.08 0.00 -1.10 0.00 0.00 59.98 59.00 3itv h ARG 412 Cb 0.25 -0.21 -0.01 0.00 -1.39 0.00 0.00 29.97 28.60 3itv h ARG 412 CO -0.22 0.68 -0.19 0.00 2.80 0.00 0.00 179.97 183.04 3itv h ALA 413 N 1.25 1.20 0.38 2.80 0.00 -1.86 -0.55 119.26 122.48 3itv h ALA 413 Ca 0.27 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3itv h ALA 413 Cb -0.08 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3itv h ALA 413 CO -0.05 0.51 -0.18 -0.09 0.00 0.00 0.00 179.25 179.44 3itv h ARG 414 N 0.42 -0.49 0.00 0.00 2.43 -0.08 -2.05 114.38 114.61 3itv h ARG 414 Ca 0.07 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3itv h ARG 414 Cb 0.57 0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 3itv h ARG 414 CO 0.04 -0.24 -0.15 -0.39 -1.51 0.00 0.00 179.97 177.72 3itv h VAL 415 N -0.66 0.43 -0.60 0.20 -1.51 -0.96 -1.19 116.25 111.95 3itv h VAL 415 Ca -0.05 -0.81 -0.10 0.00 -1.23 0.00 0.00 66.70 64.50 3itv h VAL 415 Cb 0.48 1.58 -0.02 0.00 -2.13 0.00 0.00 31.29 31.20 3itv h VAL 415 CO 0.09 0.14 -0.02 0.00 -1.23 0.00 0.00 177.57 176.55 3itv h ALA 416 N 1.85 0.84 -0.05 5.19 0.00 -0.90 0.31 119.26 126.50 3itv h ALA 416 Ca -0.00 -0.32 -0.16 0.00 0.00 0.00 0.00 54.91 54.43 3itv h ALA 416 Cb 0.57 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3itv h ALA 416 CO 0.02 0.67 -0.69 0.00 0.00 0.00 0.00 179.25 179.25 3itv h ALA 417 N 1.00 0.73 0.00 0.00 0.00 -0.65 -3.16 119.26 117.19 3itv h ALA 417 Ca 0.17 -0.60 -0.13 0.00 0.00 0.00 0.00 54.91 54.35 3itv h ALA 417 Cb 0.58 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3itv h ALA 417 CO 0.03 0.79 -0.63 0.93 0.00 0.00 0.00 179.25 180.37 3itv h GLU 418 N 0.16 0.00 -2.28 0.00 5.08 -0.96 -3.37 114.58 113.21 3itv h GLU 418 Ca -0.02 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.72 3itv h GLU 418 Cb 1.24 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.09 3itv h GLU 418 CO 0.11 0.63 -0.42 0.54 -1.00 0.00 0.00 179.01 178.87 3itv n ARG 419 N -3.28 2.97 -1.74 2.33 1.74 0.10 -5.07 116.66 113.72 3itv n ARG 419 Ca 0.01 -4.71 -0.39 0.00 -0.77 0.00 0.00 57.85 52.00 3itv n ARG 419 Cb 0.78 -2.29 0.04 0.00 -1.02 0.00 0.00 32.46 29.97 3itv n ARG 419 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3itv n PRO 420 N 0.62 1.73 0.00 5.56 -0.04 -1.24 -4.44 135.00 137.20 3itv n PRO 420 Ca 0.30 0.63 0.00 0.00 -0.04 0.00 0.00 63.50 64.40 3itv n PRO 420 Cb 0.39 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.28 3itv n PRO 420 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46