#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 0.71 -5.21 -1.08 2.47 -1.93 -3.40 114.38 105.94 3itv h ARG 5 Ca 0.00 -0.16 -0.65 0.00 -1.26 0.00 0.00 59.98 57.92 3itv h ARG 5 Cb 0.00 -0.10 -0.24 0.00 -1.65 0.00 0.00 29.97 27.97 3itv h ARG 5 CO 0.00 0.69 -0.70 0.42 0.56 0.00 0.00 179.97 180.93 3itv s ILE 6 N -5.08 3.58 0.17 2.04 -1.09 -1.26 -5.02 121.20 114.53 3itv s ILE 6 Ca -0.09 -0.46 -0.34 0.00 -2.23 0.00 0.00 60.65 57.54 3itv s ILE 6 Cb 0.15 -2.58 -0.14 0.00 -1.58 0.00 0.00 42.46 38.32 3itv s ILE 6 CO 0.79 0.47 1.51 0.00 -1.23 0.00 0.00 174.94 176.48 3itv n ALA 7 N 3.93 1.01 0.09 9.38 0.00 -1.26 -4.87 120.51 128.79 3itv n ALA 7 Ca -0.18 0.45 0.04 0.00 0.00 0.00 0.00 53.44 53.75 3itv n ALA 7 Cb 0.52 -2.30 0.45 0.00 0.00 0.00 0.00 19.45 18.13 3itv n ALA 7 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3itv h GLN 8 N 5.36 0.35 0.00 0.00 4.20 -1.98 -1.55 115.11 121.49 3itv h GLN 8 Ca -0.45 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.19 3itv h GLN 8 Cb 1.27 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.97 3itv h GLN 8 CO 0.84 0.30 -0.16 0.38 -0.67 0.00 0.00 178.83 179.53 3itv h ASP 9 N 0.35 0.00 0.02 1.46 2.03 -1.98 0.15 116.42 118.44 3itv h ASP 9 Ca 0.09 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.24 3itv h ASP 9 Cb 0.09 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.60 3itv h ASP 9 CO -0.01 0.16 -0.57 0.58 -1.03 0.00 0.00 179.24 178.36 3itv h VAL 10 N 0.00 1.47 -0.66 4.15 2.07 -1.66 -1.43 116.25 120.18 3itv h VAL 10 Ca -0.00 -2.14 -0.03 0.00 0.82 0.00 0.00 66.70 65.35 3itv h VAL 10 Cb 0.46 2.73 -0.03 0.00 -1.52 0.00 0.00 31.29 32.94 3itv h VAL 10 CO 0.02 0.61 0.30 0.58 0.02 0.00 0.00 177.57 179.10 3itv h VAL 11 N -0.22 1.23 -0.15 2.57 2.07 -1.16 -1.16 116.25 119.43 3itv h VAL 11 Ca -0.08 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 3itv h VAL 11 Cb 1.32 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 3itv h VAL 11 CO 0.11 0.28 0.08 0.00 0.02 0.00 0.00 177.57 178.06 3itv h ALA 12 N 1.13 0.19 -0.32 1.67 0.00 -0.75 -0.30 119.26 120.88 3itv h ALA 12 Ca 0.23 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3itv h ALA 12 Cb 0.16 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3itv h ALA 12 CO -0.02 -0.26 0.20 -0.09 0.00 0.00 0.00 179.25 179.08 3itv h ARG 13 N 0.13 0.40 -0.24 0.00 2.43 -1.05 -0.21 114.38 115.84 3itv h ARG 13 Ca 0.05 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.08 3itv h ARG 13 Cb 0.10 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3itv h ARG 13 CO -0.01 0.27 -0.33 0.93 -1.51 0.00 0.00 179.97 179.32 3itv h GLU 14 N 0.41 0.51 -0.35 0.20 4.39 -1.12 -1.19 114.58 117.43 3itv h GLU 14 Ca 0.12 -0.23 -0.11 0.00 0.34 0.00 0.00 59.36 59.49 3itv h GLU 14 Cb -0.03 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 3itv h GLU 14 CO -0.04 0.78 -0.19 -0.91 -1.16 0.00 0.00 179.01 177.49 3itv h ASN 15 N 0.44 0.78 -0.48 1.42 4.21 -0.79 -2.86 115.58 118.30 3itv h ASN 15 Ca 0.05 -0.41 -0.05 0.00 1.21 0.00 0.00 56.30 57.10 3itv h ASN 15 Cb 0.79 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 37.75 3itv h ASN 15 CO 0.06 1.02 0.12 0.44 -1.29 0.00 0.00 177.43 177.79 3itv h ASP 16 N 0.54 0.77 0.02 5.81 3.32 -0.88 -0.55 116.42 125.45 3itv h ASP 16 Ca 0.08 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 3itv h ASP 16 Cb 0.74 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 3itv h ASP 16 CO 0.06 0.76 -0.05 -0.09 -1.72 0.00 0.00 179.24 178.20 3itv h ARG 17 N 0.80 0.10 -0.31 3.56 2.43 -1.07 -2.82 114.38 117.06 3itv h ARG 17 Ca 0.17 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3itv h ARG 17 Cb 0.31 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3itv h ARG 17 CO 0.00 0.16 0.00 0.54 -1.51 0.00 0.00 179.97 179.16 3itv n ARG 18 N -4.42 2.23 -0.19 0.20 1.74 -0.90 -4.67 116.66 110.65 3itv n ARG 18 Ca -0.02 -1.94 -0.07 0.00 -0.77 0.00 0.00 57.85 55.06 3itv n ARG 18 Cb 0.17 -1.33 0.03 0.00 -1.02 0.00 0.00 32.46 30.31 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 2.71 0.71 -0.07 7.54 0.00 -0.84 -2.07 119.26 127.23 3itv h ALA 19 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3itv h ALA 19 Cb 0.74 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 3itv h ALA 19 CO 0.00 0.18 0.05 1.03 0.00 0.00 0.00 179.25 180.50 3itv h SER 20 N 0.75 0.08 -0.65 0.00 0.87 -1.83 -1.19 113.55 111.58 3itv h SER 20 Ca 0.20 -0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.70 3itv h SER 20 Cb -0.04 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 3itv h SER 20 CO -0.04 0.07 0.24 0.00 -0.53 0.00 0.00 176.83 176.57 3itv h ALA 21 N 1.01 0.85 -0.67 6.23 0.00 -1.88 -1.99 119.26 122.82 3itv h ALA 21 Ca 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3itv h ALA 21 Cb 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3itv h ALA 21 CO -0.01 0.49 0.38 1.25 0.00 0.00 0.00 179.25 181.37 3itv h LEU 22 N 0.93 0.82 0.05 0.00 5.85 -1.20 -0.45 115.31 121.31 3itv h LEU 22 Ca 0.21 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.86 3itv h LEU 22 Cb 0.24 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3itv h LEU 22 CO -0.01 0.66 -0.06 0.50 -0.34 0.00 0.00 178.44 179.19 3itv h LYS 23 N 0.91 -0.13 -0.52 1.25 3.64 -0.92 0.22 116.57 121.03 3itv h LYS 23 Ca 0.24 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.64 3itv h LYS 23 Cb 0.01 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 3itv h LYS 23 CO -0.04 -0.09 0.33 0.93 -2.27 0.00 0.00 179.45 178.31 3itv h GLU 24 N -0.13 0.64 -0.29 1.90 4.39 -1.09 -1.19 114.58 118.82 3itv h GLU 24 Ca 0.01 -0.04 -0.17 0.00 0.34 0.00 0.00 59.36 59.50 3itv h GLU 24 Cb 0.13 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.64 3itv h GLU 24 CO -0.03 0.43 -0.47 -0.44 -1.16 0.00 0.00 179.01 177.34 3itv h ASP 25 N 0.66 0.91 -0.22 1.42 3.32 -0.87 -2.30 116.42 119.34 3itv h ASP 25 Ca 0.20 -0.52 -0.04 0.00 0.02 0.00 0.00 57.03 56.69 3itv h ASP 25 Cb -0.04 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.24 3itv h ASP 25 CO -0.06 1.26 -0.00 0.22 -1.72 0.00 0.00 179.24 178.93 3itv h TYR 26 N 0.59 0.43 -0.44 4.55 3.20 -0.46 -1.23 116.97 123.60 3itv h TYR 26 Ca 0.02 -0.08 -0.07 0.00 3.14 0.00 0.00 58.73 61.74 3itv h TYR 26 Cb 1.08 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.21 3itv h TYR 26 CO 0.08 0.58 -0.02 0.93 -1.64 0.00 0.00 178.16 178.08 3itv h GLU 27 N 0.15 0.73 -0.38 1.82 5.08 -1.28 0.15 114.58 120.85 3itv h GLU 27 Ca 0.06 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.15 3itv h GLU 27 Cb 0.41 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3itv h GLU 27 CO 0.01 0.76 -0.04 0.00 -1.00 0.00 0.00 179.01 178.75 3itv h ALA 28 N 1.29 0.51 -0.53 3.43 0.00 -1.33 -1.83 119.26 120.81 3itv h ALA 28 Ca 0.13 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 3itv h ALA 28 Cb 0.46 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3itv h ALA 28 CO 0.02 0.32 0.01 1.25 0.00 0.00 0.00 179.25 180.85 3itv h LEU 29 N 0.50 0.86 -1.07 0.00 5.85 -0.89 -2.01 115.31 118.56 3itv h LEU 29 Ca 0.10 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 3itv h LEU 29 Cb 0.52 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 3itv h LEU 29 CO 0.03 0.92 0.37 1.23 -0.34 0.00 0.00 178.44 180.64 3itv h GLY 30 N 0.99 1.09 1.00 3.75 0.00 -0.46 0.70 103.07 110.14 3itv h GLY 30 Ca 0.16 -0.51 -0.12 0.00 0.00 0.00 0.00 47.33 46.85 3itv h GLY 30 CO 0.02 0.49 -0.29 0.00 0.00 0.00 0.00 176.54 176.76 3itv h ALA 31 N 1.38 0.46 -0.42 3.60 0.00 -1.05 -1.11 119.26 122.12 3itv h ALA 31 Ca 0.25 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3itv h ALA 31 Cb 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3itv h ALA 31 CO -0.04 0.48 0.18 -0.97 0.00 0.00 0.00 179.25 178.91 3itv h ASN 32 N 0.52 0.57 -0.53 0.00 -0.73 -0.94 -2.04 115.58 112.42 3itv h ASN 32 Ca 0.05 -0.15 -0.07 0.00 1.87 0.00 0.00 56.30 58.01 3itv h ASN 32 Cb 0.86 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 39.28 3itv h ASN 32 CO 0.07 0.56 0.09 -0.07 -0.37 0.00 0.00 177.43 177.72 3itv h LEU 33 N 0.53 0.87 -0.70 0.34 3.38 -0.82 -2.72 115.31 116.19 3itv h LEU 33 Ca 0.14 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3itv h LEU 33 Cb 0.16 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3itv h LEU 33 CO -0.01 0.88 0.44 0.00 0.09 0.00 0.00 178.44 179.83 3itv h ALA 34 N 1.23 0.90 0.00 1.53 0.00 -0.88 0.14 119.26 122.17 3itv h ALA 34 Ca 0.18 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3itv h ALA 34 Cb 0.38 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3itv h ALA 34 CO 0.01 0.35 -0.05 0.00 0.00 0.00 0.00 179.25 179.55 3itv h ARG 35 N 0.96 0.00 -0.16 0.00 3.08 -1.08 0.09 114.38 117.27 3itv h ARG 35 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 3itv h ARG 35 Cb -0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.99 3itv h ARG 35 CO -0.05 0.05 0.00 0.54 -1.07 0.00 0.00 179.97 179.44 3itv n ARG 36 N -3.56 1.98 -1.24 0.04 1.74 -0.27 -4.93 116.66 110.43 3itv n ARG 36 Ca -0.02 -1.46 0.00 0.00 -0.77 0.00 0.00 57.85 55.60 3itv n ARG 36 Cb 0.16 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 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 1.26 0.45 3.32 -0.13 0.00 0.02 -5.06 105.19 105.05 3itv n GLY 37 Ca 0.17 -0.95 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.00 2.38 -0.50 1.61 1.01 0.33 -4.99 120.40 118.24 3itv s VAL 38 Ca 0.00 -0.95 -0.20 0.00 0.00 0.00 0.00 61.98 60.83 3itv s VAL 38 Cb 0.00 -1.90 0.05 0.00 0.00 0.00 0.00 36.38 34.53 3itv s VAL 38 CO 0.00 0.57 0.66 -0.62 0.00 0.00 0.00 175.10 175.71 3itv s ASP 39 N -0.22 6.25 0.44 3.32 -1.08 -1.26 -2.76 116.67 121.36 3itv s ASP 39 Ca -0.01 -0.74 0.16 0.00 -0.52 0.00 0.00 52.55 51.44 3itv s ASP 39 Cb -0.13 -2.31 1.08 0.00 -1.46 0.00 0.00 42.92 40.10 3itv s ASP 39 CO 0.03 -0.91 1.93 -0.29 0.52 0.00 0.00 175.17 176.46 3itv h ILE 40 N 5.88 0.80 -0.64 4.11 2.10 -1.92 -0.85 117.51 126.99 3itv h ILE 40 Ca -0.27 -0.13 -0.05 0.00 1.08 0.00 0.00 64.86 65.49 3itv h ILE 40 Cb 1.09 0.39 -0.03 0.00 -1.09 0.00 0.00 36.82 37.19 3itv h ILE 40 CO 0.96 0.07 0.20 -0.08 -1.08 0.00 0.00 178.15 178.22 3itv h GLU 41 N 0.38 0.97 -0.62 2.19 4.57 -1.98 -0.94 114.58 119.15 3itv h GLU 41 Ca 0.35 -0.19 -0.06 0.00 -1.18 0.00 0.00 59.36 58.28 3itv h GLU 41 Cb 0.83 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 29.24 3itv h GLU 41 CO -0.10 0.83 0.15 0.00 -1.18 0.00 0.00 179.01 178.71 3itv h ALA 42 N 1.28 1.10 -0.10 2.92 0.00 -1.57 -1.10 119.26 121.78 3itv h ALA 42 Ca 0.21 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3itv h ALA 42 Cb 0.27 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3itv h ALA 42 CO -0.01 0.60 -0.07 0.28 0.00 0.00 0.00 179.25 180.05 3itv h VAL 43 N 0.92 1.34 -0.97 0.00 2.07 -1.26 -2.94 116.25 115.42 3itv h VAL 43 Ca 0.20 -1.16 0.03 0.00 0.82 0.00 0.00 66.70 66.58 3itv h VAL 43 Cb 0.33 1.90 -0.05 0.00 -1.52 0.00 0.00 31.29 31.94 3itv h VAL 43 CO -0.00 0.33 0.64 0.74 0.02 0.00 0.00 177.57 179.29 3itv h THR 44 N -0.16 1.20 -0.31 2.57 2.02 -1.04 -0.03 112.91 117.15 3itv h THR 44 Ca 0.02 -0.43 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 3itv h THR 44 Cb 0.56 -0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 3itv h THR 44 CO 0.02 0.23 0.16 0.00 0.37 0.00 0.00 175.52 176.30 3itv h ALA 45 N 1.38 1.71 0.23 6.16 0.00 -1.17 -0.71 119.26 126.86 3itv h ALA 45 Ca 0.37 -0.06 -0.34 0.00 0.00 0.00 0.00 54.91 54.89 3itv h ALA 45 Cb -0.06 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 17.63 3itv h ALA 45 CO -0.10 0.25 -1.53 0.87 0.00 0.00 0.00 179.25 178.74 3itv h LYS 46 N 0.42 0.50 -0.87 0.00 1.57 -1.15 -3.33 116.57 113.71 3itv h LYS 46 Ca 0.11 -0.85 -0.00 0.00 -1.87 0.00 0.00 60.65 58.04 3itv h LYS 46 Cb 0.02 0.32 -0.04 0.00 0.08 0.00 0.00 32.23 32.61 3itv h LYS 46 CO -0.02 1.41 0.53 0.28 -0.57 0.00 0.00 179.45 181.08 3itv h VAL 47 N 0.11 1.24 0.00 0.50 2.07 -0.64 -1.25 116.25 118.27 3itv h VAL 47 Ca -0.28 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 66.74 3itv h VAL 47 Cb 2.13 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 3itv h VAL 47 CO 0.25 0.24 0.00 -1.84 0.02 0.00 0.00 177.57 176.24 3itv n GLU 48 N -4.43 0.01 -0.02 1.57 0.28 -0.31 -1.76 120.64 115.98 3itv n GLU 48 Ca 0.09 0.30 0.08 0.00 -0.16 0.00 0.00 57.16 57.48 3itv n GLU 48 Cb 0.05 -1.50 0.08 0.00 1.43 0.00 0.00 31.44 31.50 3itv n GLU 48 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3itv n LYS 49 N -1.49 1.47 -3.00 3.44 4.76 -0.49 -4.94 118.16 117.90 3itv n LYS 49 Ca 0.03 -1.58 -0.41 0.00 -2.87 0.00 0.00 58.31 53.48 3itv n LYS 49 Cb 0.13 -1.33 -0.05 0.00 -1.84 0.00 0.00 35.03 31.94 3itv n LYS 49 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 3itv s PHE 50 N -1.38 3.29 0.09 2.13 5.36 -0.72 -5.05 117.98 121.70 3itv s PHE 50 Ca 0.21 0.96 0.10 0.00 -0.96 0.00 0.00 56.93 57.24 3itv s PHE 50 Cb 0.14 -2.96 -0.03 0.00 -0.34 0.00 0.00 43.02 39.83 3itv s PHE 50 CO 0.21 -0.37 -0.26 -0.06 -1.46 0.00 0.00 175.22 173.28 3itv s PHE 51 N 2.68 2.34 -0.03 10.12 0.08 -1.26 -4.74 117.98 127.17 3itv s PHE 51 Ca 0.30 -0.38 0.01 0.00 0.12 0.00 0.00 56.93 56.98 3itv s PHE 51 Cb -0.15 -1.33 0.02 0.00 -0.57 0.00 0.00 43.02 40.99 3itv s PHE 51 CO 0.08 0.24 -0.03 0.54 -0.10 0.00 0.00 175.22 175.95 3itv s VAL 52 N -0.94 0.34 0.31 -0.44 0.11 -0.24 -4.71 120.40 114.84 3itv s VAL 52 Ca 0.13 -0.05 -0.29 0.00 -2.93 0.00 0.00 61.98 58.84 3itv s VAL 52 Cb -0.10 -0.38 -0.10 0.00 -1.53 0.00 0.00 36.38 34.27 3itv s VAL 52 CO 0.04 0.16 1.22 0.00 -3.33 0.00 0.00 175.10 173.19 3itv s ALA 53 N 0.72 3.45 -0.12 1.54 0.00 0.01 -4.25 121.76 123.11 3itv s ALA 53 Ca -0.08 1.10 -0.11 0.00 0.00 0.00 0.00 51.96 52.87 3itv s ALA 53 Cb -0.11 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.55 3itv s ALA 53 CO -0.01 -0.44 0.24 0.54 0.00 0.00 0.00 175.76 176.09 3itv s VAL 54 N -1.16 5.33 -0.00 0.00 0.11 -0.64 -0.95 120.40 123.09 3itv s VAL 54 Ca 0.47 0.44 -0.30 0.00 -2.93 0.00 0.00 61.98 59.67 3itv s VAL 54 Cb -0.36 -3.54 -0.03 0.00 -1.53 0.00 0.00 36.38 30.91 3itv s VAL 54 CO 0.48 0.52 0.96 -2.16 -3.33 0.00 0.00 175.10 171.57 3itv s PRO 55 N -0.42 4.55 0.35 1.54 0.04 -1.25 -0.72 135.00 139.09 3itv s PRO 55 Ca 0.16 1.39 0.04 0.00 0.04 0.00 0.00 61.00 62.63 3itv s PRO 55 Cb -0.13 -3.46 0.63 0.00 0.04 0.00 0.00 34.50 31.58 3itv s PRO 55 CO 0.05 -0.04 1.92 0.66 0.04 0.00 0.00 177.00 179.63 3itv h SER 56 N 6.79 0.55 0.37 6.66 4.64 -1.76 -1.84 113.55 128.95 3itv h SER 56 Ca -0.41 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3itv h SER 56 Cb 1.22 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3itv h SER 56 CO 0.75 0.54 0.00 -2.67 -0.87 0.00 0.00 176.83 174.58 3itv n TRP 57 N -4.33 0.00 0.91 4.77 2.14 -1.26 -2.58 117.44 117.08 3itv n TRP 57 Ca 0.03 0.00 0.11 0.00 2.07 0.00 0.00 57.50 59.70 3itv n TRP 57 Cb 0.18 -0.25 0.06 0.00 -0.81 0.00 0.00 31.31 30.49 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 0.55 0.52 0.14 -1.67 0.00 -0.69 -4.30 105.19 99.74 3itv n GLY 58 Ca 0.11 -0.62 0.02 0.00 0.00 0.00 0.00 46.02 45.53 3itv n GLY 58 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3itv h VAL 59 N 3.61 0.98 -1.98 1.61 2.07 -1.54 -3.43 116.25 117.57 3itv h VAL 59 Ca 0.00 -2.25 -0.44 0.00 0.82 0.00 0.00 66.70 64.82 3itv h VAL 59 Cb 0.84 2.39 0.01 0.00 -1.52 0.00 0.00 31.29 33.01 3itv h VAL 59 CO 0.00 0.53 -0.31 -0.83 0.02 0.00 0.00 177.57 176.99 3itv s GLY 60 N -4.47 1.56 0.30 2.17 0.00 -1.26 -4.62 107.32 101.00 3itv s GLY 60 Ca 0.03 -1.38 -0.29 0.00 0.00 0.00 0.00 44.72 43.08 3itv s GLY 60 CO 0.74 -1.29 1.23 -1.59 0.00 0.00 0.00 173.10 172.20 3itv s THR 61 N -2.22 3.03 0.25 0.90 2.01 -1.26 -4.61 115.64 113.74 3itv s THR 61 Ca 0.45 1.02 0.01 0.00 0.31 0.00 0.00 61.69 63.48 3itv s THR 61 Cb -0.10 -3.65 0.05 0.00 0.01 0.00 0.00 72.50 68.81 3itv s THR 61 CO 0.32 0.24 0.35 0.61 -0.69 0.00 0.00 174.62 175.45 3itv n GLY 62 N 1.05 1.13 3.82 4.40 0.00 -0.02 -4.93 105.19 110.64 3itv n GLY 62 Ca -0.00 -2.05 -0.08 0.00 0.00 0.00 0.00 46.02 43.90 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 -3.26 0.28 0.53 -0.02 0.00 -1.26 -4.34 107.32 99.24 3itv s GLY 63 Ca 0.24 -0.63 0.02 0.00 0.00 0.00 0.00 44.72 44.34 3itv s GLY 63 CO 0.16 0.10 0.13 -1.30 0.00 0.00 0.00 173.10 172.19 3itv n THR 64 N -0.55 0.00 0.40 0.90 -2.24 -0.36 -4.99 114.28 107.45 3itv n THR 64 Ca -0.07 -2.39 0.07 0.00 -2.27 0.00 0.00 64.05 59.40 3itv n THR 64 Cb 0.60 0.34 0.33 0.00 -2.10 0.00 0.00 70.33 69.49 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 -1.45 0.05 -0.00 -0.78 1.85 -1.26 -2.71 116.66 112.35 3itv n ARG 65 Ca -0.16 0.34 -0.17 0.00 -1.00 0.00 0.00 57.85 56.86 3itv n ARG 65 Cb 0.65 -1.60 -0.14 0.00 -1.05 0.00 0.00 32.46 30.32 3itv n ARG 65 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3itv n PHE 66 N -1.70 1.20 -3.61 2.89 3.72 -1.26 -5.05 117.46 113.65 3itv n PHE 66 Ca 0.03 0.31 -0.01 0.00 -0.05 0.00 0.00 57.45 57.73 3itv n PHE 66 Cb 0.16 -1.18 -0.01 0.00 -0.94 0.00 0.00 39.48 37.51 3itv n PHE 66 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3itv s ALA 67 N -2.57 -2.23 -0.04 4.37 0.00 -1.10 -5.15 121.76 115.04 3itv s ALA 67 Ca -0.16 1.45 0.03 0.00 0.00 0.00 0.00 51.96 53.28 3itv s ALA 67 Cb 0.07 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.12 3itv s ALA 67 CO 0.79 -0.74 -0.11 0.50 0.00 0.00 0.00 175.76 176.21 3itv s ARG 68 N -2.21 1.28 -0.65 0.00 3.52 -1.26 -1.22 118.95 118.41 3itv s ARG 68 Ca 0.12 -0.36 0.05 0.00 -0.13 0.00 0.00 55.73 55.41 3itv s ARG 68 Cb 0.02 -1.14 0.16 0.00 -1.56 0.00 0.00 34.95 32.43 3itv s ARG 68 CO -0.04 0.09 0.45 -0.06 -0.81 0.00 0.00 175.30 174.93 3itv s PHE 69 N 0.38 3.25 0.67 5.12 0.08 -1.26 -5.07 117.98 121.15 3itv s PHE 69 Ca -0.07 -3.20 -0.17 0.00 0.12 0.00 0.00 56.93 53.60 3itv s PHE 69 Cb -0.12 -2.52 -0.00 0.00 -0.57 0.00 0.00 43.02 39.81 3itv s PHE 69 CO 0.02 -0.60 1.25 -0.35 -0.10 0.00 0.00 175.22 175.44 3itv n PRO 70 N 2.20 0.97 -0.53 0.24 -0.04 -1.26 -4.95 135.00 131.62 3itv n PRO 70 Ca 0.19 0.39 0.00 0.00 -0.04 0.00 0.00 63.50 64.04 3itv n PRO 70 Cb 0.36 -2.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 3itv n PRO 70 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3itv n GLY 71 N 0.91 1.69 3.90 0.55 0.00 -1.26 -5.10 105.19 105.89 3itv n GLY 71 Ca 0.15 -2.06 -0.28 0.00 0.00 0.00 0.00 46.02 43.83 3itv n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3itv s THR 72 N 1.27 4.92 -1.39 2.61 -4.23 -1.26 -4.33 115.64 113.23 3itv s THR 72 Ca 0.00 0.23 -0.05 0.00 -1.18 0.00 0.00 61.69 60.70 3itv s THR 72 Cb 0.00 -3.78 0.01 0.00 1.34 0.00 0.00 72.50 70.06 3itv s THR 72 CO 0.00 -0.56 0.61 0.61 -0.54 0.00 0.00 174.62 174.74 3itv n GLY 73 N -1.50 -0.40 3.76 3.99 0.00 -1.26 -4.78 105.19 104.99 3itv n GLY 73 Ca -0.00 0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 3itv n GLY 73 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3itv s GLU 74 N -5.65 4.21 0.32 1.61 0.41 -1.26 -4.75 118.70 113.60 3itv s GLU 74 Ca 0.30 2.42 -0.29 0.00 -0.41 0.00 0.00 54.97 56.98 3itv s GLU 74 Cb -0.13 -3.05 -0.12 0.00 -1.78 0.00 0.00 34.13 29.05 3itv s GLU 74 CO 0.37 -0.46 1.52 -0.35 -0.49 0.00 0.00 175.26 175.85 3itv n PRO 75 N 1.62 2.58 0.08 0.39 -0.04 -1.26 -4.85 135.00 133.52 3itv n PRO 75 Ca 0.05 0.91 -0.06 0.00 -0.04 0.00 0.00 63.50 64.36 3itv n PRO 75 Cb 0.40 -2.65 0.07 0.00 -0.04 0.00 0.00 33.50 31.28 3itv n PRO 75 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3itv h ARG 76 N 3.91 0.23 0.00 0.54 3.08 -1.92 -3.48 114.38 116.73 3itv h ARG 76 Ca -0.48 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.39 3itv h ARG 76 Cb 1.24 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3itv h ARG 76 CO 0.72 0.84 0.00 0.41 -1.07 0.00 0.00 179.97 180.87 3itv n GLY 77 N 0.48 1.97 0.32 0.04 0.00 -1.26 -5.02 105.19 101.72 3itv n GLY 77 Ca -0.03 -0.73 -0.01 0.00 0.00 0.00 0.00 46.02 45.25 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 0.16 1.21 -0.65 -0.61 6.09 -1.91 -1.79 117.51 120.01 3itv h ILE 78 Ca 0.00 -0.64 -0.08 0.00 -1.37 0.00 0.00 64.86 62.77 3itv h ILE 78 Cb 0.00 0.50 -0.03 0.00 0.47 0.00 0.00 36.82 37.76 3itv h ILE 78 CO 0.00 0.26 0.11 -0.26 -3.07 0.00 0.00 178.15 175.19 3itv h PHE 79 N 0.84 1.12 -0.48 2.19 0.04 -1.97 0.12 116.94 118.81 3itv h PHE 79 Ca 0.20 -0.15 -0.11 0.00 2.80 0.00 0.00 57.97 60.72 3itv h PHE 79 Cb 0.15 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 37.98 3itv h PHE 79 CO 0.01 0.94 -0.12 -0.44 -0.60 0.00 0.00 178.31 178.10 3itv h ASP 80 N 1.00 0.89 -0.78 2.17 5.19 -1.90 -1.99 116.42 121.00 3itv h ASP 80 Ca 0.20 -0.29 -0.05 0.00 -0.62 0.00 0.00 57.03 56.27 3itv h ASP 80 Cb 0.42 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 39.65 3itv h ASP 80 CO 0.01 1.03 0.30 0.11 -3.12 0.00 0.00 179.24 177.56 3itv h LYS 81 N 0.80 1.18 -0.63 3.56 1.57 -0.72 -1.62 116.57 120.71 3itv h LYS 81 Ca 0.13 -0.23 -0.07 0.00 -1.87 0.00 0.00 60.65 58.62 3itv h LYS 81 Cb 0.65 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 3itv h LYS 81 CO 0.05 0.97 0.13 -0.07 -0.57 0.00 0.00 179.45 179.96 3itv h LEU 82 N 1.15 0.97 -0.96 2.94 3.38 -0.53 0.08 115.31 122.34 3itv h LEU 82 Ca 0.26 -0.24 0.05 0.00 0.09 0.00 0.00 57.88 58.03 3itv h LEU 82 Cb 0.24 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 3itv h LEU 82 CO -0.02 0.96 0.62 0.44 0.09 0.00 0.00 178.44 180.54 3itv h ASP 83 N 0.93 1.02 -0.12 -0.43 3.32 -0.91 0.24 116.42 120.47 3itv h ASP 83 Ca 0.19 -0.00 -0.17 0.00 0.02 0.00 0.00 57.03 57.08 3itv h ASP 83 Cb 0.39 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.71 3itv h ASP 83 CO 0.01 0.68 -0.52 0.44 -1.72 0.00 0.00 179.24 178.13 3itv h ASP 84 N 1.17 0.77 0.01 6.45 3.32 -0.84 -2.75 116.42 124.55 3itv h ASP 84 Ca 0.39 -0.40 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 3itv h ASP 84 Cb 0.06 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3itv h ASP 84 CO -0.14 1.14 -0.11 0.00 -1.72 0.00 0.00 179.24 178.42 3itv h ALA 86 N 1.69 1.71 -0.11 0.00 0.00 -0.68 -1.55 119.26 120.32 3itv h ALA 86 Ca 0.05 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3itv h ALA 86 Cb 0.33 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3itv h ALA 86 CO 0.02 0.22 -0.11 0.28 0.00 0.00 0.00 179.25 179.66 3itv h VAL 87 N 0.00 1.36 -0.53 0.00 2.07 -1.23 -0.83 116.25 117.09 3itv h VAL 87 Ca -0.00 -1.26 0.03 0.00 0.82 0.00 0.00 66.70 66.30 3itv h VAL 87 Cb 0.31 1.94 -0.04 0.00 -1.52 0.00 0.00 31.29 31.98 3itv h VAL 87 CO 0.02 0.36 0.30 0.40 0.02 0.00 0.00 177.57 178.67 3itv h ILE 88 N -0.13 1.01 -0.32 4.57 2.04 -1.26 -1.49 117.51 121.93 3itv h ILE 88 Ca 0.02 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.63 3itv h ILE 88 Cb 0.62 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 3itv h ILE 88 CO 0.03 0.11 0.00 -0.61 0.00 0.00 0.00 178.15 177.67 3itv h GLN 89 N 0.59 0.57 -0.78 2.37 5.75 -1.29 -0.36 115.11 121.96 3itv h GLN 89 Ca 0.22 -0.18 0.03 0.00 -0.15 0.00 0.00 58.65 58.57 3itv h GLN 89 Cb 0.07 -0.05 -0.05 0.00 1.07 0.00 0.00 27.48 28.52 3itv h GLN 89 CO -0.12 0.70 0.49 0.37 -2.65 0.00 0.00 178.83 177.62 3itv h GLN 90 N 0.37 0.93 0.17 1.69 4.15 -0.84 0.49 115.11 122.07 3itv h GLN 90 Ca 0.09 -0.06 -0.31 0.00 0.77 0.00 0.00 58.65 59.14 3itv h GLN 90 Cb 0.44 -0.21 0.01 0.00 0.21 0.00 0.00 27.48 27.93 3itv h GLN 90 CO 0.02 0.62 -1.46 -0.07 -1.93 0.00 0.00 178.83 176.01 3itv h LEU 91 N 0.96 0.56 0.00 -2.39 3.38 -1.21 -3.35 115.31 113.26 3itv h LEU 91 Ca 0.31 -0.66 -0.24 0.00 0.09 0.00 0.00 57.88 57.38 3itv h LEU 91 Cb 0.01 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 3itv h LEU 91 CO -0.11 1.53 -2.11 0.35 0.09 0.00 0.00 178.44 178.20 3itv n THR 92 N -3.57 0.99 -1.62 0.22 -2.24 -0.15 -1.09 114.28 106.82 3itv n THR 92 Ca -0.15 -0.73 -0.19 0.00 -2.27 0.00 0.00 64.05 60.71 3itv n THR 92 Cb 1.06 -0.40 -0.07 0.00 -2.10 0.00 0.00 70.33 68.81 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 -2.65 -1.45 -0.01 -0.78 5.12 0.17 -4.78 116.66 112.28 3itv n ARG 93 Ca -0.21 1.08 0.03 0.00 -1.93 0.00 0.00 57.85 56.83 3itv n ARG 93 Cb 0.95 -5.46 0.03 0.00 -1.16 0.00 0.00 32.46 26.82 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 0.83 2.45 -3.09 7.54 0.00 -1.26 -4.78 120.51 122.19 3itv n ALA 94 Ca -0.19 -0.61 -0.22 0.00 0.00 0.00 0.00 53.44 52.42 3itv n ALA 94 Cb 0.62 -0.23 -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 0.34 1.15 0.30 0.00 -2.24 -1.26 -1.08 114.28 111.49 3itv n THR 95 Ca 0.04 -4.99 0.18 0.00 -2.27 0.00 0.00 64.05 57.01 3itv n THR 95 Cb 0.19 -0.74 0.77 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 3.01 0.00 -6.59 -0.78 0.13 -1.86 -3.41 132.00 122.49 3itv h PRO 96 Ca 0.11 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.57 3itv h PRO 96 Cb 0.78 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 31.73 3itv h PRO 96 CO 0.63 0.00 -0.77 -0.80 -0.23 0.00 0.00 178.00 176.83 3itv s ASN 97 N -5.39 4.11 -0.01 1.44 0.02 -1.26 -0.37 114.94 113.48 3itv s ASN 97 Ca 0.00 -0.43 0.07 0.00 -1.02 0.00 0.00 52.86 51.48 3itv s ASN 97 Cb 0.10 -0.71 -0.03 0.00 0.02 0.00 0.00 41.25 40.63 3itv s ASN 97 CO 0.49 0.21 -0.21 -0.69 0.02 0.00 0.00 177.10 176.92 3itv s VAL 98 N -1.10 2.52 -0.25 1.60 1.01 -0.21 -1.62 120.40 122.35 3itv s VAL 98 Ca 0.18 -1.05 -0.13 0.00 0.00 0.00 0.00 61.98 60.98 3itv s VAL 98 Cb -0.11 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 3itv s VAL 98 CO 0.10 0.50 0.29 -0.44 0.00 0.00 0.00 175.10 175.55 3itv s SER 99 N -0.92 6.21 0.12 3.32 0.01 0.10 -0.67 113.70 121.87 3itv s SER 99 Ca 0.12 0.23 -0.03 0.00 1.31 0.00 0.00 55.95 57.58 3itv s SER 99 Cb -0.10 -2.17 -0.05 0.00 0.21 0.00 0.00 66.02 63.91 3itv s SER 99 CO 0.01 -0.07 0.32 -0.76 0.41 0.00 0.00 173.24 173.15 3itv s LEU 100 N 1.59 4.30 -0.11 2.44 1.43 -1.25 -1.90 118.68 125.18 3itv s LEU 100 Ca 0.12 0.48 0.02 0.00 -1.03 0.00 0.00 54.13 53.72 3itv s LEU 100 Cb -0.15 -3.19 0.01 0.00 0.03 0.00 0.00 46.19 42.89 3itv s LEU 100 CO 0.08 0.09 -0.16 -2.28 0.23 0.00 0.00 176.35 174.31 3itv s HIS 101 N -1.61 2.04 -0.07 0.29 2.46 -1.26 -1.26 115.29 115.87 3itv s HIS 101 Ca 0.39 -0.96 -0.01 0.00 0.47 0.00 0.00 55.06 54.95 3itv s HIS 101 Cb -0.12 -1.46 -0.03 0.00 -0.13 0.00 0.00 32.58 30.83 3itv s HIS 101 CO 0.26 -0.48 -0.01 0.42 -2.47 0.00 0.00 174.74 172.46 3itv s ILE 102 N 0.94 4.23 -2.14 0.89 -1.09 -0.28 0.03 121.20 123.78 3itv s ILE 102 Ca -0.07 -0.31 0.20 0.00 -2.23 0.00 0.00 60.65 58.24 3itv s ILE 102 Cb -0.15 -2.79 0.52 0.00 -1.58 0.00 0.00 42.46 38.46 3itv s ILE 102 CO -0.01 0.58 1.67 -0.81 -1.23 0.00 0.00 174.94 175.14 3itv n PRO 103 N 2.06 1.33 -0.24 2.79 -0.04 -1.26 -2.27 135.00 137.37 3itv n PRO 103 Ca -0.18 -0.50 0.03 0.00 -0.04 0.00 0.00 63.50 62.81 3itv n PRO 103 Cb 0.53 -1.35 0.16 0.00 -0.04 0.00 0.00 33.50 32.80 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 1.03 0.49 -0.59 0.54 6.55 -1.88 -1.95 115.95 120.13 3itv h TRP 104 Ca 0.00 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.87 3itv h TRP 104 Cb 0.22 -0.11 0.00 0.00 -0.86 0.00 0.00 29.16 28.41 3itv h TRP 104 CO 0.04 0.09 0.00 -0.25 -1.05 0.00 0.00 178.44 177.28 3itv n ASP 105 N -4.99 5.61 -4.72 -3.49 8.00 0.10 -4.76 116.55 112.31 3itv n ASP 105 Ca 0.12 -2.87 -0.42 0.00 0.71 0.00 0.00 54.79 52.33 3itv n ASP 105 Cb 0.35 -0.67 -0.03 0.00 -0.02 0.00 0.00 41.12 40.75 3itv n ASP 105 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3itv s LYS 106 N -2.64 4.15 0.14 -1.24 2.20 -0.74 -4.92 119.74 116.69 3itv s LYS 106 Ca 0.54 2.54 -0.25 0.00 -0.36 0.00 0.00 55.97 58.44 3itv s LYS 106 Cb 0.41 -3.12 0.08 0.00 -1.51 0.00 0.00 37.83 33.68 3itv s LYS 106 CO 0.17 -0.72 1.03 0.00 -0.36 0.00 0.00 175.35 175.48 3itv s ALA 107 N 1.24 -1.72 -0.02 3.13 0.00 -1.26 -5.02 121.76 118.12 3itv s ALA 107 Ca 0.74 0.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.45 3itv s ALA 107 Cb -0.48 0.64 -0.08 0.00 0.00 0.00 0.00 23.12 23.21 3itv s ALA 107 CO 0.32 -1.05 2.01 0.34 0.00 0.00 0.00 175.76 177.37 3itv s ASP 108 N -3.11 6.26 0.29 0.00 2.15 -1.26 -4.86 116.67 116.14 3itv s ASP 108 Ca 0.16 2.50 0.03 0.00 0.43 0.00 0.00 52.55 55.67 3itv s ASP 108 Cb -0.01 -2.53 0.67 0.00 -0.30 0.00 0.00 42.92 40.75 3itv s ASP 108 CO 0.02 -1.23 1.75 -0.65 -0.17 0.00 0.00 175.17 174.89 3itv h PRO 109 N 11.45 0.59 -0.86 4.34 0.11 -1.96 0.05 132.00 145.71 3itv h PRO 109 Ca -0.48 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 3itv h PRO 109 Cb 1.24 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 3itv h PRO 109 CO 0.95 0.39 0.47 0.87 -0.21 0.00 0.00 178.00 180.46 3itv h LYS 110 N 0.60 1.19 -0.32 1.05 1.57 -1.89 -0.55 116.57 118.22 3itv h LYS 110 Ca 0.54 -0.14 -0.16 0.00 -1.87 0.00 0.00 60.65 59.01 3itv h LYS 110 Cb 0.87 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.94 3itv h LYS 110 CO -0.42 0.88 -0.45 0.93 -0.57 0.00 0.00 179.45 179.82 3itv h GLU 111 N 1.20 0.84 -0.14 3.15 5.08 -1.43 -0.51 114.58 122.77 3itv h GLU 111 Ca 0.30 -0.48 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 3itv h GLU 111 Cb 0.03 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3itv h GLU 111 CO -0.05 1.11 0.08 -0.07 -1.00 0.00 0.00 179.01 179.08 3itv h LEU 112 N 0.67 0.18 -0.87 1.33 3.38 -0.79 -1.08 115.31 118.13 3itv h LEU 112 Ca 0.04 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3itv h LEU 112 Cb 1.03 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 3itv h LEU 112 CO 0.10 0.22 0.56 0.50 0.09 0.00 0.00 178.44 179.90 3itv h LYS 113 N 0.13 1.17 -0.46 1.13 1.63 -1.05 -0.35 116.57 118.76 3itv h LYS 113 Ca 0.05 -0.09 -0.02 0.00 -0.85 0.00 0.00 60.65 59.74 3itv h LYS 113 Cb 0.08 -0.25 -0.02 0.00 -0.60 0.00 0.00 32.23 31.43 3itv h LYS 113 CO -0.01 0.79 0.21 0.00 -3.45 0.00 0.00 179.45 176.99 3itv h ALA 114 N 1.30 0.59 -0.41 5.00 0.00 -0.75 -0.33 119.26 124.67 3itv h ALA 114 Ca 0.32 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 3itv h ALA 114 Cb -0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3itv h ALA 114 CO -0.06 0.17 -0.14 -0.09 0.00 0.00 0.00 179.25 179.13 3itv h ARG 115 N 0.60 0.82 -0.01 0.00 9.65 -0.91 -1.70 114.38 122.83 3itv h ARG 115 Ca 0.16 -0.33 0.01 0.00 -1.10 0.00 0.00 59.98 58.72 3itv h ARG 115 Cb 0.14 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.67 3itv h ARG 115 CO -0.02 0.96 -0.06 0.78 2.80 0.00 0.00 179.97 184.43 3itv h GLY 116 N 0.64 -0.06 0.97 2.80 0.00 -0.85 -1.47 103.07 105.10 3itv h GLY 116 Ca 0.10 0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.52 3itv h GLY 116 CO 0.05 -0.07 0.62 -0.55 0.00 0.00 0.00 176.54 176.58 3itv h ASP 117 N -0.11 1.05 -0.13 0.19 3.32 -1.00 0.19 116.42 119.93 3itv h ASP 117 Ca 0.03 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 3itv h ASP 117 Cb 0.14 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 3itv h ASP 117 CO -0.07 0.75 -0.04 0.00 -1.72 0.00 0.00 179.24 178.16 3itv h ALA 118 N 1.35 1.45 -0.00 3.45 0.00 -0.96 -2.71 119.26 121.84 3itv h ALA 118 Ca 0.35 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3itv h ALA 118 Cb -0.10 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3itv h ALA 118 CO -0.09 0.39 -0.46 1.28 0.00 0.00 0.00 179.25 180.37 3itv n LEU 119 N -4.29 0.72 -0.11 0.00 4.77 -0.58 -4.94 117.00 112.56 3itv n LEU 119 Ca 0.01 -0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 3itv n LEU 119 Cb 0.24 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3itv n LEU 119 CO 0.38 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 3itv n GLY 120 N 1.45 0.54 3.41 -0.72 0.00 -0.31 -4.93 105.19 104.64 3itv n GLY 120 Ca 0.07 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.23 2.41 0.00 0.99 1.43 0.51 -4.91 118.68 118.88 3itv s LEU 121 Ca 0.00 -0.70 0.01 0.00 -1.03 0.00 0.00 54.13 52.41 3itv s LEU 121 Cb 0.00 -1.30 0.01 0.00 0.03 0.00 0.00 46.19 44.92 3itv s LEU 121 CO 0.00 0.18 0.04 0.61 0.23 0.00 0.00 176.35 177.42 3itv n GLY 122 N 0.91 3.67 3.11 -3.19 0.00 0.50 -3.84 105.19 106.36 3itv n GLY 122 Ca -0.17 -2.28 -0.26 0.00 0.00 0.00 0.00 46.02 43.31 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 -1.82 1.68 0.00 1.61 0.40 -1.26 -1.04 117.98 117.55 3itv s PHE 123 Ca 0.03 -0.52 0.00 0.00 -0.60 0.00 0.00 56.93 55.84 3itv s PHE 123 Cb -0.00 -1.15 0.00 0.00 0.51 0.00 0.00 43.02 42.38 3itv s PHE 123 CO 0.02 -0.20 0.00 -3.47 0.70 0.00 0.00 175.22 172.27 3itv n ASP 124 N 3.29 0.00 -4.71 1.36 2.03 0.15 -4.29 116.55 114.38 3itv n ASP 124 Ca -0.19 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.71 3itv n ASP 124 Cb 0.53 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.94 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 1.47 -1.81 -1.67 0.00 -1.26 -4.57 120.51 109.67 3itv n ALA 125 Ca 0.00 0.29 -0.32 0.00 0.00 0.00 0.00 53.44 53.41 3itv n ALA 125 Cb 0.00 -2.29 -0.01 0.00 0.00 0.00 0.00 19.45 17.15 3itv n ALA 125 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3itv s MET 126 N -2.17 3.68 -0.08 0.00 -1.94 0.06 -3.87 119.30 114.98 3itv s MET 126 Ca 0.59 0.90 0.01 0.00 -1.71 0.00 0.00 55.69 55.48 3itv s MET 126 Cb -0.51 -2.09 0.02 0.00 2.01 0.00 0.00 34.83 34.26 3itv s MET 126 CO 0.59 -0.50 -0.09 -0.80 -0.01 0.00 0.00 175.02 174.21 3itv s ASN 127 N -3.51 1.84 0.47 3.03 0.01 -0.39 -0.28 114.94 116.10 3itv s ASN 127 Ca 0.58 -0.28 -0.04 0.00 -0.71 0.00 0.00 52.86 52.41 3itv s ASN 127 Cb -0.11 -0.78 -0.03 0.00 0.41 0.00 0.00 41.25 40.74 3itv s ASN 127 CO 0.42 -0.04 0.75 -0.94 -1.51 0.00 0.00 177.10 175.78 3itv s SER 128 N 1.14 6.12 -0.32 -1.22 1.04 -1.14 -1.13 113.70 118.18 3itv s SER 128 Ca -0.06 0.74 -0.02 0.00 0.48 0.00 0.00 55.95 57.10 3itv s SER 128 Cb -0.14 -2.05 0.11 0.00 0.10 0.00 0.00 66.02 64.04 3itv s SER 128 CO -0.02 -0.62 0.14 0.21 0.98 0.00 0.00 173.24 173.94 3itv s ASN 129 N -4.14 3.66 -0.21 7.02 3.84 -0.96 -4.66 114.94 119.48 3itv s ASN 129 Ca 0.47 -1.69 0.14 0.00 0.21 0.00 0.00 52.86 51.99 3itv s ASN 129 Cb -0.10 -0.62 0.45 0.00 -0.55 0.00 0.00 41.25 40.42 3itv s ASN 129 CO 0.43 -0.39 1.19 0.35 -2.79 0.00 0.00 177.10 175.88 3itv n THR 130 N 4.74 1.83 -0.09 -5.21 -2.24 -1.26 -4.61 114.28 107.44 3itv n THR 130 Ca -0.00 -3.16 0.03 0.00 -2.27 0.00 0.00 64.05 58.65 3itv n THR 130 Cb 0.40 -0.11 0.09 0.00 -2.10 0.00 0.00 70.33 68.61 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 -0.65 0.27 -3.58 4.78 1.16 -1.26 -4.58 117.46 113.59 3itv n PHE 131 Ca 0.23 -0.48 -0.14 0.00 -1.87 0.00 0.00 57.45 55.19 3itv n PHE 131 Cb 0.87 -0.03 -0.06 0.00 -1.61 0.00 0.00 39.48 38.65 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 -0.45 -0.10 5.98 1.04 -1.26 -4.93 113.70 113.00 3itv s SER 132 Ca 0.14 0.26 -0.15 0.00 0.48 0.00 0.00 55.95 56.67 3itv s SER 132 Cb 0.07 0.48 -0.05 0.00 0.10 0.00 0.00 66.02 66.63 3itv s SER 132 CO 0.09 -0.67 0.38 -1.81 0.98 0.00 0.00 173.24 172.21 3itv s ASP 133 N -1.78 6.62 0.28 7.02 1.01 -1.26 -4.87 116.67 123.70 3itv s ASP 133 Ca -0.07 0.74 0.03 0.00 0.71 0.00 0.00 52.55 53.96 3itv s ASP 133 Cb -0.01 -2.23 -0.03 0.00 1.01 0.00 0.00 42.92 41.66 3itv s ASP 133 CO 0.01 0.14 0.43 0.00 0.21 0.00 0.00 175.17 175.96 3itv s ALA 134 N 0.03 3.85 0.46 5.23 0.00 -1.26 -5.06 121.76 125.01 3itv s ALA 134 Ca 0.22 -1.12 -0.24 0.00 0.00 0.00 0.00 51.96 50.82 3itv s ALA 134 Cb -0.15 -1.87 -0.07 0.00 0.00 0.00 0.00 23.12 21.03 3itv s ALA 134 CO 0.09 0.13 1.25 -1.25 0.00 0.00 0.00 175.76 175.98 3itv s PRO 135 N -4.11 3.67 0.00 0.00 0.04 -1.26 -3.46 135.00 129.88 3itv s PRO 135 Ca 0.37 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.39 3itv s PRO 135 Cb -0.09 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 31.98 3itv s PRO 135 CO 0.32 -0.68 0.00 0.41 0.04 0.00 0.00 177.00 177.09 3itv n GLY 136 N 0.58 0.77 3.76 0.56 0.00 -1.26 -5.03 105.19 104.57 3itv n GLY 136 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3itv n GLY 136 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3itv s GLN 137 N -0.20 4.44 0.33 1.61 -0.21 -1.22 -4.91 119.66 119.49 3itv s GLN 137 Ca 0.00 2.07 0.14 0.00 0.02 0.00 0.00 55.36 57.59 3itv s GLN 137 Cb 0.00 -3.13 0.53 0.00 1.00 0.00 0.00 33.01 31.41 3itv s GLN 137 CO 0.00 -0.09 1.69 0.00 -2.12 0.00 0.00 175.29 174.76 3itv h ALA 138 N 3.92 1.02 -3.78 6.09 0.00 -1.95 -3.44 119.26 121.12 3itv h ALA 138 Ca -0.47 -0.45 -0.34 0.00 0.00 0.00 0.00 54.91 53.65 3itv h ALA 138 Cb 1.22 -0.08 -0.27 0.00 0.00 0.00 0.00 17.79 18.66 3itv h ALA 138 CO 0.68 0.61 -0.76 -1.01 0.00 0.00 0.00 179.25 178.78 3itv s HIS 139 N -3.67 0.63 0.31 0.00 3.76 -1.26 -5.11 115.29 109.96 3itv s HIS 139 Ca -0.01 -0.20 -0.15 0.00 -0.15 0.00 0.00 55.06 54.55 3itv s HIS 139 Cb 0.12 -0.40 -0.09 0.00 1.11 0.00 0.00 32.58 33.33 3itv s HIS 139 CO 0.73 -0.02 0.72 0.45 -0.85 0.00 0.00 174.74 175.76 3itv s SER 140 N -0.50 6.77 -0.12 1.40 0.15 -1.26 -4.98 113.70 115.16 3itv s SER 140 Ca -0.00 1.25 0.15 0.00 0.70 0.00 0.00 55.95 58.05 3itv s SER 140 Cb -0.04 -2.36 0.63 0.00 -1.71 0.00 0.00 66.02 62.54 3itv s SER 140 CO -0.00 -0.18 1.51 -1.22 1.20 0.00 0.00 173.24 174.54 3itv n TYR 141 N -0.30 1.36 -0.24 3.44 4.01 -1.26 -4.53 117.16 119.63 3itv n TYR 141 Ca 0.03 -0.53 0.04 0.00 -0.16 0.00 0.00 57.90 57.29 3itv n TYR 141 Cb 0.53 -0.26 0.17 0.00 -0.31 0.00 0.00 39.34 39.47 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 3.46 0.37 -0.55 -0.72 3.64 -1.95 -1.77 116.57 119.05 3itv h LYS 142 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3itv h LYS 142 Cb 1.36 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 3itv h LYS 142 CO 0.24 0.24 0.00 0.66 -2.27 0.00 0.00 179.45 178.32 3itv n TYR 143 N -5.05 1.55 0.00 1.91 4.01 -1.26 -5.04 117.16 113.28 3itv n TYR 143 Ca 0.13 -0.68 0.00 0.00 -0.16 0.00 0.00 57.90 57.19 3itv n TYR 143 Cb 0.40 -0.33 0.00 0.00 -0.31 0.00 0.00 39.34 39.10 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 0.69 2.01 0.00 2.72 0.00 -0.67 -4.69 105.19 105.26 3itv n GLY 144 Ca 0.25 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.27 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 -4.26 113.62 113.40 3itv n SER 145 Ca 0.00 0.00 0.19 0.00 -0.26 0.00 0.00 58.87 58.80 3itv n SER 145 Cb 0.00 0.00 0.90 0.00 -0.26 0.00 0.00 64.21 64.85 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 -2.95 1.04 3.38 -1.87 -2.45 115.31 112.46 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 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.99 3itv n SER 147 N -2.96 2.49 -4.68 -0.43 3.41 -1.26 -3.69 113.62 106.51 3itv n SER 147 Ca -0.01 -2.05 -0.39 0.00 -0.26 0.00 0.00 58.87 56.16 3itv n SER 147 Cb 0.18 -0.13 0.04 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 -0.05 1.60 0.24 7.33 -0.00 -0.92 -4.79 115.22 118.64 3itv n HIS 148 Ca 0.06 0.46 0.10 0.00 -0.00 0.00 0.00 57.72 58.34 3itv n HIS 148 Cb 0.36 -2.26 0.62 0.00 -0.00 0.00 0.00 29.99 28.70 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 1.16 0.75 -3.39 3.57 1.35 -1.91 -3.42 112.91 111.01 3itv h THR 149 Ca -0.49 -0.70 -0.60 0.00 -0.55 0.00 0.00 66.41 64.07 3itv h THR 149 Cb 1.33 1.43 -0.09 0.00 -1.73 0.00 0.00 68.15 69.09 3itv h THR 149 CO 0.55 0.17 0.52 0.21 -0.25 0.00 0.00 175.52 176.72 3itv s ASN 150 N -6.39 6.74 0.31 5.36 2.47 -1.26 -4.94 114.94 117.23 3itv s ASN 150 Ca -0.03 0.78 0.03 0.00 0.42 0.00 0.00 52.86 54.07 3itv s ASN 150 Cb 0.13 -2.44 0.62 0.00 -1.45 0.00 0.00 41.25 38.11 3itv s ASN 150 CO 0.63 -0.68 1.87 0.00 -3.72 0.00 0.00 177.10 175.19 3itv h ALA 151 N 8.08 1.61 -0.35 1.71 0.00 -1.99 -1.05 119.26 127.27 3itv h ALA 151 Ca -0.23 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 3itv h ALA 151 Cb 1.09 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 3itv h ALA 151 CO 0.92 0.18 0.04 0.00 0.00 0.00 0.00 179.25 180.39 3itv h ALA 152 N 1.55 1.43 -0.34 0.00 0.00 -1.96 -0.56 119.26 119.38 3itv h ALA 152 Ca 0.45 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 55.02 3itv h ALA 152 Cb 0.47 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 3itv h ALA 152 CO -0.22 0.41 -0.46 1.15 0.00 0.00 0.00 179.25 180.13 3itv h THR 153 N 0.50 1.27 -0.61 0.00 2.02 -1.57 -1.99 112.91 112.54 3itv h THR 153 Ca 0.11 -1.64 -0.06 0.00 0.77 0.00 0.00 66.41 65.60 3itv h THR 153 Cb 0.26 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 3itv h THR 153 CO 0.00 0.54 0.14 0.03 0.37 0.00 0.00 175.52 176.60 3itv h ARG 154 N 0.73 0.98 -0.70 6.66 3.08 -0.87 -1.82 114.38 122.43 3itv h ARG 154 Ca 0.04 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 59.83 3itv h ARG 154 Cb 1.06 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.95 3itv h ARG 154 CO 0.11 0.90 0.35 0.00 -1.07 0.00 0.00 179.97 180.25 3itv h ALA 155 N 1.04 1.30 -0.62 0.04 0.00 -1.01 -0.50 119.26 119.50 3itv h ALA 155 Ca 0.19 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3itv h ALA 155 Cb 0.37 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3itv h ALA 155 CO 0.00 0.55 0.07 0.37 0.00 0.00 0.00 179.25 180.25 3itv h GLN 156 N 0.99 1.05 -0.38 0.00 4.15 -0.98 -1.41 115.11 118.52 3itv h GLN 156 Ca 0.24 -0.30 -0.11 0.00 0.77 0.00 0.00 58.65 59.26 3itv h GLN 156 Cb 0.08 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.64 3itv h GLN 156 CO -0.03 0.99 -0.22 0.00 -1.93 0.00 0.00 178.83 177.64 3itv h ALA 157 N 1.02 0.90 -0.23 3.38 0.00 -0.77 -2.15 119.26 121.41 3itv h ALA 157 Ca 0.19 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 3itv h ALA 157 Cb 0.47 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3itv h ALA 157 CO 0.02 0.62 0.07 0.28 0.00 0.00 0.00 179.25 180.24 3itv h VAL 158 N 0.66 1.20 -0.65 0.00 2.07 -0.84 -2.24 116.25 116.44 3itv h VAL 158 Ca 0.09 -0.62 0.01 0.00 0.82 0.00 0.00 66.70 67.00 3itv h VAL 158 Cb 0.72 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 3itv h VAL 158 CO 0.06 0.20 0.43 -0.08 0.02 0.00 0.00 177.57 178.20 3itv h GLU 159 N 0.20 0.84 -0.52 1.57 4.57 -1.14 -1.04 114.58 119.07 3itv h GLU 159 Ca 0.07 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 3itv h GLU 159 Cb 0.24 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 3itv h GLU 159 CO -0.00 0.55 0.23 1.25 -1.18 0.00 0.00 179.01 179.86 3itv h HIS 160 N 0.86 0.77 -0.43 0.92 2.76 -1.06 -1.27 115.15 117.70 3itv h HIS 160 Ca 0.24 -0.05 -0.07 0.00 -2.20 0.00 0.00 60.37 58.29 3itv h HIS 160 Cb -0.07 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 28.63 3itv h HIS 160 CO -0.00 0.62 -0.03 -0.91 -1.30 0.00 0.00 177.93 176.31 3itv h ASN 161 N 0.70 0.68 -0.05 3.26 2.35 -0.76 -2.00 115.58 119.76 3itv h ASN 161 Ca 0.18 -0.17 -0.08 0.00 -0.55 0.00 0.00 56.30 55.68 3itv h ASN 161 Cb 0.16 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 3itv h ASN 161 CO -0.02 0.77 -0.21 -0.07 -1.65 0.00 0.00 177.43 176.25 3itv h LEU 162 N 0.66 0.44 -0.90 1.61 3.38 -0.84 -2.09 115.31 117.57 3itv h LEU 162 Ca 0.13 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 3itv h LEU 162 Cb 0.46 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3itv h LEU 162 CO 0.02 0.66 -0.14 -0.08 0.09 0.00 0.00 178.44 179.00 3itv h GLU 163 N 0.40 0.66 -0.44 1.13 4.81 -0.73 -1.70 114.58 118.71 3itv h GLU 163 Ca 0.06 -0.22 -0.06 0.00 -0.13 0.00 0.00 59.36 59.02 3itv h GLU 163 Cb 0.60 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.90 3itv h GLU 163 CO 0.04 0.78 0.04 0.00 -0.73 0.00 0.00 179.01 179.14 3itv h ILE 165 N 0.67 1.27 -0.58 0.00 2.04 -0.86 -0.71 117.51 119.34 3itv h ILE 165 Ca 0.14 -1.44 -0.03 0.00 1.00 0.00 0.00 64.86 64.53 3itv h ILE 165 Cb 0.36 1.24 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 3itv h ILE 165 CO 0.01 0.49 0.24 -0.33 0.00 0.00 0.00 178.15 178.56 3itv h GLU 166 N 0.78 0.86 -0.46 2.37 4.39 -0.85 0.59 114.58 122.25 3itv h GLU 166 Ca 0.09 -0.15 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 3itv h GLU 166 Cb 0.85 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.34 3itv h GLU 166 CO 0.07 0.73 0.09 0.82 -1.16 0.00 0.00 179.01 179.56 3itv h ILE 167 N 0.79 1.24 -0.69 3.13 2.04 -1.16 -2.78 117.51 120.09 3itv h ILE 167 Ca 0.19 -0.87 -0.02 0.00 1.00 0.00 0.00 64.86 65.16 3itv h ILE 167 Cb 0.18 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 3itv h ILE 167 CO -0.02 0.31 0.36 1.23 0.00 0.00 0.00 178.15 180.03 3itv h GLY 168 N 0.63 1.04 1.30 5.37 0.00 -0.74 -2.52 103.07 108.15 3itv h GLY 168 Ca 0.14 -0.49 0.02 0.00 0.00 0.00 0.00 47.33 47.00 3itv h GLY 168 CO 0.01 0.47 0.45 0.50 0.00 0.00 0.00 176.54 177.97 3itv h LYS 169 N 0.95 0.85 0.00 4.80 1.57 -0.76 0.25 116.57 124.23 3itv h LYS 169 Ca 0.24 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.91 3itv h LYS 169 Cb 0.08 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 3itv h LYS 169 CO -0.03 0.57 -0.30 0.00 -0.57 0.00 0.00 179.45 179.12 3itv h ALA 170 N 1.59 0.89 -0.01 3.86 0.00 -1.18 -3.30 119.26 121.11 3itv h ALA 170 Ca 0.26 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3itv h ALA 170 Cb -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3itv h ALA 170 CO -0.06 0.37 -0.60 0.44 0.00 0.00 0.00 179.25 179.40 3itv n ILE 171 N -3.29 0.00 0.00 0.00 -6.64 -0.96 -4.83 119.36 103.64 3itv n ILE 171 Ca 0.01 -0.20 0.00 0.00 -1.77 0.00 0.00 62.75 60.79 3itv n ILE 171 Cb 0.55 1.12 0.00 0.00 -1.44 0.00 0.00 39.64 39.87 3itv n ILE 171 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 3itv n GLY 172 N 1.34 0.93 3.79 3.28 0.00 -0.71 -4.66 105.19 109.15 3itv n GLY 172 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.89 5.25 -0.04 1.61 0.15 -0.00 -4.81 113.70 113.98 3itv s SER 173 Ca 0.00 1.81 0.05 0.00 0.70 0.00 0.00 55.95 58.51 3itv s SER 173 Cb 0.00 -2.52 0.08 0.00 -1.71 0.00 0.00 66.02 61.87 3itv s SER 173 CO 0.00 -1.53 1.01 0.29 1.20 0.00 0.00 173.24 174.21 3itv n LYS 174 N -2.72 0.44 -3.46 5.44 4.76 -1.26 -4.45 118.16 116.91 3itv n LYS 174 Ca 0.09 -1.43 -0.11 0.00 -2.87 0.00 0.00 58.31 54.00 3itv n LYS 174 Cb 0.53 -0.79 -0.02 0.00 -1.84 0.00 0.00 35.03 32.90 3itv n LYS 174 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3itv s ALA 175 N -0.83 -1.70 -0.09 7.82 0.00 -1.26 -2.02 121.76 123.68 3itv s ALA 175 Ca 0.09 0.74 0.01 0.00 0.00 0.00 0.00 51.96 52.80 3itv s ALA 175 Cb 0.08 0.64 0.02 0.00 0.00 0.00 0.00 23.12 23.86 3itv s ALA 175 CO 0.01 -0.72 -0.10 -1.17 0.00 0.00 0.00 175.76 173.78 3itv s LEU 176 N -2.56 1.44 -0.21 0.00 2.96 -0.67 -0.76 118.68 118.87 3itv s LEU 176 Ca 0.02 -0.29 -0.08 0.00 -0.22 0.00 0.00 54.13 53.55 3itv s LEU 176 Cb -0.01 -0.82 -0.04 0.00 0.50 0.00 0.00 46.19 45.82 3itv s LEU 176 CO -0.10 -0.04 0.09 -0.89 -1.32 0.00 0.00 176.35 174.09 3itv s THR 177 N 1.13 4.90 -0.31 3.68 2.01 0.61 -0.25 115.64 127.41 3itv s THR 177 Ca -0.06 0.01 -0.01 0.00 0.31 0.00 0.00 61.69 61.94 3itv s THR 177 Cb -0.14 -3.24 0.06 0.00 0.01 0.00 0.00 72.50 69.18 3itv s THR 177 CO -0.02 0.41 0.01 -0.69 -0.69 0.00 0.00 174.62 173.64 3itv s VAL 178 N 0.74 2.92 -0.10 3.82 1.01 0.15 -2.91 120.40 126.04 3itv s VAL 178 Ca 0.05 -1.50 0.03 0.00 0.00 0.00 0.00 61.98 60.56 3itv s VAL 178 Cb -0.13 -2.72 0.01 0.00 0.00 0.00 0.00 36.38 33.53 3itv s VAL 178 CO 0.02 -0.17 -0.19 0.86 0.00 0.00 0.00 175.10 175.63 3itv s TRP 179 N 1.22 2.18 0.20 5.22 -0.00 -1.26 -2.04 118.94 124.45 3itv s TRP 179 Ca -0.04 -0.95 0.06 0.00 -0.00 0.00 0.00 56.10 55.17 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 -0.02 -0.44 -0.11 0.96 -0.00 0.00 0.00 176.95 177.35 3itv s ILE 180 N 0.66 1.47 -2.12 5.86 -4.36 -1.26 -4.69 121.20 116.77 3itv s ILE 180 Ca -0.13 -2.14 0.26 0.00 -0.26 0.00 0.00 60.65 58.38 3itv s ILE 180 Cb -0.16 -2.05 0.27 0.00 1.25 0.00 0.00 42.46 41.76 3itv s ILE 180 CO 0.03 -0.59 1.47 0.61 0.24 0.00 0.00 174.94 176.71 3itv n GLY 181 N -0.34 -0.16 3.35 6.27 0.00 -1.26 -4.95 105.19 108.08 3itv n GLY 181 Ca -0.08 -0.49 -0.58 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.12 0.53 0.00 1.61 9.92 -1.26 -4.09 116.55 123.14 3itv n ASP 182 Ca 0.13 1.09 0.00 0.00 -0.53 0.00 0.00 54.79 55.48 3itv n ASP 182 Cb 0.40 -0.83 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 2.48 -0.54 3.12 0.44 0.00 -1.26 -1.61 105.19 107.82 3itv n GLY 183 Ca 0.23 -0.77 -0.10 0.00 0.00 0.00 0.00 46.02 45.38 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 0.85 0.00 1.61 1.04 0.47 -4.90 113.70 108.77 3itv s SER 184 Ca 0.00 -0.89 0.12 0.00 0.48 0.00 0.00 55.95 55.66 3itv s SER 184 Cb 0.00 0.11 -0.03 0.00 0.10 0.00 0.00 66.02 66.21 3itv s SER 184 CO 0.00 -0.45 0.68 0.59 0.98 0.00 0.00 173.24 175.04 3itv n ASN 185 N 0.36 1.22 -3.91 7.02 4.13 -1.26 -1.22 115.26 121.60 3itv n ASN 185 Ca -0.15 -1.11 -0.12 0.00 1.68 0.00 0.00 54.58 54.87 3itv n ASN 185 Cb 0.59 0.57 -0.14 0.00 -1.54 0.00 0.00 39.78 39.27 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 -1.68 0.16 0.35 3.10 0.08 -1.26 -4.38 117.98 114.35 3itv s PHE 186 Ca 0.09 -0.12 -0.29 0.00 0.12 0.00 0.00 56.93 56.74 3itv s PHE 186 Cb 0.10 -0.10 -0.11 0.00 -0.57 0.00 0.00 43.02 42.33 3itv s PHE 186 CO 0.35 -0.03 1.53 -2.14 -0.10 0.00 0.00 175.22 174.83 3itv s PRO 187 N -0.30 4.10 0.00 0.24 0.02 -1.26 -1.72 135.00 136.07 3itv s PRO 187 Ca -0.02 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.59 3itv s PRO 187 Cb -0.02 -2.98 0.00 0.00 0.02 0.00 0.00 34.50 31.52 3itv s PRO 187 CO -0.00 -0.59 0.00 0.41 -0.33 0.00 0.00 177.00 176.49 3itv n GLY 188 N 0.99 2.96 0.32 0.52 0.00 -1.26 -4.87 105.19 103.85 3itv n GLY 188 Ca 0.03 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.11 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 0.83 0.77 -6.56 1.61 4.15 -1.77 -3.42 115.11 110.72 3itv h GLN 189 Ca 0.00 -0.05 -0.63 0.00 0.77 0.00 0.00 58.65 58.74 3itv h GLN 189 Cb 0.00 -0.17 -0.22 0.00 0.21 0.00 0.00 27.48 27.29 3itv h GLN 189 CO 0.00 0.51 -0.85 -1.12 -1.93 0.00 0.00 178.83 175.44 3itv s SER 190 N -5.56 2.96 -0.41 -0.69 0.01 -1.26 -5.09 113.70 103.66 3itv s SER 190 Ca -0.12 -0.71 -0.19 0.00 1.31 0.00 0.00 55.95 56.24 3itv s SER 190 Cb 0.21 -0.19 0.02 0.00 0.21 0.00 0.00 66.02 66.27 3itv s SER 190 CO 0.79 0.13 0.56 0.21 0.41 0.00 0.00 173.24 175.34 3itv s ASN 191 N -1.92 6.29 0.19 2.44 3.84 -1.26 -4.96 114.94 119.56 3itv s ASN 191 Ca 0.11 -0.35 -0.16 0.00 0.21 0.00 0.00 52.86 52.66 3itv s ASN 191 Cb -0.10 -2.28 0.17 0.00 -0.55 0.00 0.00 41.25 38.49 3itv s ASN 191 CO 0.05 -0.65 1.63 -0.26 -2.79 0.00 0.00 177.10 175.07 3itv h PHE 192 N 8.73 -0.44 -0.14 0.43 0.04 -1.98 -0.82 116.94 122.77 3itv h PHE 192 Ca -0.26 0.05 -0.03 0.00 2.80 0.00 0.00 57.97 60.53 3itv h PHE 192 Cb 1.11 0.28 -0.00 0.00 2.20 0.00 0.00 35.95 39.53 3itv h PHE 192 CO 0.70 -0.28 -0.04 1.15 -0.60 0.00 0.00 178.31 179.24 3itv h THR 193 N -0.06 1.30 -0.79 -1.55 2.02 -1.99 -2.28 112.91 109.55 3itv h THR 193 Ca 0.25 -1.01 -0.03 0.00 0.77 0.00 0.00 66.41 66.39 3itv h THR 193 Cb 0.45 1.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 3itv h THR 193 CO -0.57 0.30 0.38 0.03 0.37 0.00 0.00 175.52 176.02 3itv h ARG 194 N -0.04 1.14 -0.72 6.66 3.08 -1.94 0.34 114.38 122.91 3itv h ARG 194 Ca 0.03 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 59.91 3itv h ARG 194 Cb 0.48 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 3itv h ARG 194 CO 0.02 0.89 0.42 0.00 -1.07 0.00 0.00 179.97 180.23 3itv h ALA 195 N 1.20 0.92 -0.45 0.04 0.00 -1.14 -0.24 119.26 119.59 3itv h ALA 195 Ca 0.27 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 3itv h ALA 195 Cb 0.12 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3itv h ALA 195 CO -0.03 0.41 -0.13 0.35 0.00 0.00 0.00 179.25 179.85 3itv h PHE 196 N 0.99 0.90 -0.58 0.00 3.57 -0.91 -1.85 116.94 119.06 3itv h PHE 196 Ca 0.26 -0.17 -0.06 0.00 3.53 0.00 0.00 57.97 61.53 3itv h PHE 196 Cb -0.01 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.48 3itv h PHE 196 CO -0.01 0.89 0.14 0.93 -2.23 0.00 0.00 178.31 178.03 3itv h GLU 197 N 0.73 0.93 -0.76 1.11 5.08 -0.37 -0.58 114.58 120.73 3itv h GLU 197 Ca 0.12 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 3itv h GLU 197 Cb 0.62 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 3itv h GLU 197 CO 0.04 0.87 0.42 0.00 -1.00 0.00 0.00 179.01 179.34 3itv h ARG 198 N 0.84 1.06 -0.41 2.33 3.08 -0.80 -1.70 114.38 118.79 3itv h ARG 198 Ca 0.18 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 3itv h ARG 198 Cb 0.35 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 3itv h ARG 198 CO 0.00 0.79 0.22 -0.92 -1.07 0.00 0.00 179.97 178.99 3itv h TYR 199 N 1.06 0.56 -0.54 3.04 5.03 -0.94 -2.03 116.97 123.15 3itv h TYR 199 Ca 0.27 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.55 3itv h TYR 199 Cb 0.03 -0.18 -0.03 0.00 1.55 0.00 0.00 36.73 38.11 3itv h TYR 199 CO 0.00 0.43 0.28 -0.07 -1.32 0.00 0.00 178.16 177.48 3itv h LEU 200 N 0.53 0.66 -0.27 2.82 3.38 -0.66 0.01 115.31 121.77 3itv h LEU 200 Ca 0.14 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 3itv h LEU 200 Cb 0.06 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 3itv h LEU 200 CO -0.02 0.54 -0.36 -1.28 0.09 0.00 0.00 178.44 177.41 3itv h SER 201 N 0.75 0.79 -0.49 -0.43 0.87 -1.04 -1.75 113.55 112.25 3itv h SER 201 Ca 0.19 -0.50 -0.05 0.00 -1.23 0.00 0.00 61.79 60.20 3itv h SER 201 Cb 0.04 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.75 3itv h SER 201 CO -0.03 1.13 0.12 0.00 -0.53 0.00 0.00 176.83 177.52 3itv h ALA 202 N 0.68 0.65 0.00 6.23 0.00 -0.93 -2.60 119.26 123.28 3itv h ALA 202 Ca 0.03 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 3itv h ALA 202 Cb 0.95 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3itv h ALA 202 CO 0.09 0.34 -0.37 0.52 0.00 0.00 0.00 179.25 179.82 3itv h MET 203 N 0.67 0.00 -0.39 0.00 2.07 -1.00 -2.15 114.93 114.14 3itv h MET 203 Ca 0.15 0.00 -0.07 0.00 -2.07 0.00 0.00 59.70 57.72 3itv h MET 203 Cb 0.33 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.04 3itv h MET 203 CO 0.00 0.37 -0.03 0.00 1.07 0.00 0.00 176.91 178.32 3itv h ALA 204 N 1.63 1.22 -0.30 6.32 0.00 -0.95 0.56 119.26 127.74 3itv h ALA 204 Ca -0.00 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 3itv h ALA 204 Cb 0.67 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3itv h ALA 204 CO 0.05 0.51 -0.17 0.93 0.00 0.00 0.00 179.25 180.57 3itv h GLU 205 N 0.59 0.64 -0.81 0.00 5.08 -1.07 -2.59 114.58 116.43 3itv h GLU 205 Ca 0.12 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.16 3itv h GLU 205 Cb 0.42 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 3itv h GLU 205 CO 0.02 0.88 0.41 0.82 -1.00 0.00 0.00 179.01 180.14 3itv h ILE 206 N 0.40 1.25 -0.97 3.13 2.04 -1.04 -2.48 117.51 119.83 3itv h ILE 206 Ca 0.06 -0.67 0.08 0.00 1.00 0.00 0.00 64.86 65.34 3itv h ILE 206 Cb 0.70 0.20 -0.07 0.00 -0.74 0.00 0.00 36.82 36.91 3itv h ILE 206 CO 0.05 0.29 0.62 0.22 0.00 0.00 0.00 178.15 179.33 3itv h TYR 207 N 1.14 1.12 0.00 1.37 5.03 -0.72 -0.36 116.97 124.55 3itv h TYR 207 Ca 0.28 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.62 3itv h TYR 207 Cb 0.09 -0.37 0.00 0.00 1.55 0.00 0.00 36.73 38.00 3itv h TYR 207 CO 0.01 0.55 0.00 0.87 -1.32 0.00 0.00 178.16 178.27 3itv h LYS 208 N 1.07 0.00 -0.28 1.82 1.57 -1.05 -1.99 116.57 117.71 3itv h LYS 208 Ca 0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.21 3itv h LYS 208 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 3itv h LYS 208 CO -0.19 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.10 3itv n GLY 209 N -0.75 0.88 3.71 3.86 0.00 -0.15 -4.93 105.19 107.82 3itv n GLY 209 Ca -0.02 -0.53 -0.41 0.00 0.00 0.00 0.00 46.02 45.06 3itv n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3itv s LEU 210 N -1.45 4.36 1.02 0.99 1.43 -0.75 -5.02 118.68 119.26 3itv s LEU 210 Ca 0.34 1.51 -0.12 0.00 -1.03 0.00 0.00 54.13 54.83 3itv s LEU 210 Cb 0.19 -3.40 0.20 0.00 0.03 0.00 0.00 46.19 43.21 3itv s LEU 210 CO 0.27 -0.19 1.08 -2.84 0.23 0.00 0.00 176.35 174.90 3itv s PRO 211 N 0.85 0.25 0.40 1.29 0.02 -1.26 -4.89 135.00 131.66 3itv s PRO 211 Ca 0.47 0.98 0.11 0.00 0.02 0.00 0.00 61.00 62.57 3itv s PRO 211 Cb -0.20 -1.68 0.91 0.00 0.02 0.00 0.00 34.50 33.55 3itv s PRO 211 CO 0.25 -2.97 1.95 -0.44 -0.33 0.00 0.00 177.00 175.46 3itv h ASP 212 N -2.09 0.51 -0.62 2.53 3.32 -2.00 -2.58 116.42 115.49 3itv h ASP 212 Ca -0.53 0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.38 3itv h ASP 212 Cb 1.30 -0.09 -0.09 0.00 0.22 0.00 0.00 39.33 40.67 3itv h ASP 212 CO 0.50 0.30 0.16 -0.90 -1.72 0.00 0.00 179.24 177.59 3itv n ASP 213 N -4.49 4.73 -4.83 6.45 5.75 -1.26 -4.97 116.55 117.92 3itv n ASP 213 Ca 0.11 -3.18 -0.22 0.00 -0.01 0.00 0.00 54.79 51.49 3itv n ASP 213 Cb 0.35 -0.70 -0.04 0.00 -1.03 0.00 0.00 41.12 39.69 3itv n ASP 213 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3itv s TRP 214 N -2.95 3.15 0.14 2.11 0.52 -0.97 -4.88 118.94 116.05 3itv s TRP 214 Ca 0.53 -0.09 0.09 0.00 0.02 0.00 0.00 56.10 56.65 3itv s TRP 214 Cb 0.42 -1.43 -0.04 0.00 -1.15 0.00 0.00 33.47 31.27 3itv s TRP 214 CO 0.12 0.51 -0.21 0.15 0.02 0.00 0.00 176.95 177.54 3itv s LYS 215 N -3.74 1.26 -0.20 4.98 -0.14 -0.86 -4.85 119.74 116.20 3itv s LYS 215 Ca 0.33 -1.31 0.01 0.00 -1.36 0.00 0.00 55.97 53.64 3itv s LYS 215 Cb -0.08 -1.51 0.03 0.00 -1.68 0.00 0.00 37.83 34.59 3itv s LYS 215 CO 0.25 0.34 -0.18 -1.17 -0.76 0.00 0.00 175.35 173.83 3itv s LEU 216 N -2.26 2.43 -0.18 3.17 2.96 -0.04 -1.68 118.68 123.08 3itv s LEU 216 Ca 0.12 -0.82 -0.05 0.00 -0.22 0.00 0.00 54.13 53.16 3itv s LEU 216 Cb -0.08 -1.49 -0.03 0.00 0.50 0.00 0.00 46.19 45.08 3itv s LEU 216 CO 0.06 -0.04 0.01 -0.36 -1.32 0.00 0.00 176.35 174.69 3itv s PHE 217 N 1.25 3.10 -0.13 5.38 0.08 0.65 -1.05 117.98 127.25 3itv s PHE 217 Ca 0.02 -0.21 -0.04 0.00 0.12 0.00 0.00 56.93 56.81 3itv s PHE 217 Cb -0.15 -2.04 -0.04 0.00 -0.57 0.00 0.00 43.02 40.23 3itv s PHE 217 CO -0.11 -0.03 0.03 -1.54 -0.10 0.00 0.00 175.22 173.46 3itv s SER 218 N 0.56 5.38 -0.25 1.36 1.04 -0.87 0.33 113.70 121.25 3itv s SER 218 Ca -0.00 0.10 -0.04 0.00 0.48 0.00 0.00 55.95 56.49 3itv s SER 218 Cb -0.14 -1.74 0.01 0.00 0.10 0.00 0.00 66.02 64.25 3itv s SER 218 CO 0.02 0.28 -0.02 -0.70 0.98 0.00 0.00 173.24 173.80 3itv s GLU 219 N -0.27 3.07 0.54 4.02 2.12 -0.86 -1.16 118.70 126.15 3itv s GLU 219 Ca 0.07 -0.84 -0.12 0.00 0.36 0.00 0.00 54.97 54.44 3itv s GLU 219 Cb -0.12 -3.10 -0.06 0.00 0.26 0.00 0.00 34.13 31.11 3itv s GLU 219 CO 0.02 -0.35 0.96 -3.38 -0.54 0.00 0.00 175.26 171.96 3itv s HIS 220 N 1.42 3.55 -0.27 5.30 -3.43 -1.25 -4.70 115.29 115.90 3itv s HIS 220 Ca 0.03 1.26 -0.14 0.00 -0.80 0.00 0.00 55.06 55.41 3itv s HIS 220 Cb -0.16 -2.66 0.09 0.00 -1.43 0.00 0.00 32.58 28.42 3itv s HIS 220 CO -0.02 -0.47 0.64 0.21 -2.00 0.00 0.00 174.74 173.11 3itv s LYS 221 N -4.61 0.64 0.19 -0.38 2.20 -0.18 -4.76 119.74 112.84 3itv s LYS 221 Ca 0.55 1.23 -0.13 0.00 -0.36 0.00 0.00 55.97 57.27 3itv s LYS 221 Cb -0.10 0.30 0.10 0.00 -1.51 0.00 0.00 37.83 36.62 3itv s LYS 221 CO 0.43 -0.17 1.85 1.98 -0.36 0.00 0.00 175.35 179.08 3itv h MET 222 N 7.28 0.82 -2.79 4.03 1.85 -1.13 -3.35 114.93 121.65 3itv h MET 222 Ca -0.27 -0.06 0.08 0.00 -0.61 0.00 0.00 59.70 58.85 3itv h MET 222 Cb 1.19 -0.18 -0.08 0.00 0.43 0.00 0.00 31.60 32.96 3itv h MET 222 CO 0.16 0.55 0.31 1.52 -0.40 0.00 0.00 176.91 179.05 3itv s TYR 223 N -6.11 -0.25 0.00 1.39 1.13 -1.26 -4.48 117.35 107.77 3itv s TYR 223 Ca -0.13 -0.11 0.00 0.00 -1.41 0.00 0.00 57.07 55.42 3itv s TYR 223 Cb 0.13 0.65 0.00 0.00 -1.10 0.00 0.00 41.96 41.65 3itv s TYR 223 CO 0.76 -1.02 0.00 -1.91 -2.51 0.00 0.00 175.55 170.87 3itv n GLU 224 N -0.43 -0.02 0.16 -3.49 2.13 -1.26 -4.83 120.64 112.90 3itv n GLU 224 Ca -0.07 0.51 0.13 0.00 0.66 0.00 0.00 57.16 58.39 3itv n GLU 224 Cb 0.61 -0.24 0.53 0.00 0.27 0.00 0.00 31.44 32.60 3itv n GLU 224 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 3itv h PRO 225 N 0.01 0.00 -6.22 5.31 0.13 -1.93 -3.48 132.00 125.82 3itv h PRO 225 Ca 0.00 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.58 3itv h PRO 225 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 3itv h PRO 225 CO 0.00 0.00 0.18 0.00 -0.23 0.00 0.00 178.00 177.95 3itv s ALA 226 N -3.38 3.30 -1.40 -0.56 0.00 -1.26 -4.97 121.76 113.49 3itv s ALA 226 Ca 0.04 0.29 0.15 0.00 0.00 0.00 0.00 51.96 52.43 3itv s ALA 226 Cb 0.09 -3.07 0.36 0.00 0.00 0.00 0.00 23.12 20.50 3itv s ALA 226 CO 0.43 -0.08 1.28 1.19 0.00 0.00 0.00 175.76 178.57 3itv n PHE 227 N 3.48 0.51 0.03 0.00 3.72 -1.22 -4.57 117.46 119.41 3itv n PHE 227 Ca 0.00 -0.40 0.00 0.00 -0.05 0.00 0.00 57.45 57.00 3itv n PHE 227 Cb 0.51 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.03 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 0.89 -0.21 -4.00 1.38 9.36 -0.35 -4.93 117.16 119.28 3itv n TYR 228 Ca 0.14 0.04 -0.09 0.00 3.32 0.00 0.00 57.90 61.32 3itv n TYR 228 Cb 0.47 0.08 -0.11 0.00 -0.63 0.00 0.00 39.34 39.16 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 -5.44 0.30 -0.03 2.98 1.04 -0.57 -4.98 113.70 107.00 3itv s SER 229 Ca 0.00 -0.61 0.03 0.00 0.48 0.00 0.00 55.95 55.85 3itv s SER 229 Cb 0.00 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.25 3itv s SER 229 CO 0.00 -0.37 -0.10 -0.89 0.98 0.00 0.00 173.24 172.86 3itv s THR 230 N -2.02 0.89 0.09 2.02 2.01 -1.26 -0.40 115.64 116.98 3itv s THR 230 Ca -0.11 -0.41 -0.33 0.00 0.31 0.00 0.00 61.69 61.15 3itv s THR 230 Cb -0.06 -0.79 -0.15 0.00 0.01 0.00 0.00 72.50 71.50 3itv s THR 230 CO -0.03 0.28 1.60 0.58 -0.69 0.00 0.00 174.62 176.35 3itv h VAL 231 N 5.44 0.18 -3.02 3.82 2.07 -1.64 -3.06 116.25 120.03 3itv h VAL 231 Ca -0.33 0.00 -0.79 0.00 0.82 0.00 0.00 66.70 66.40 3itv h VAL 231 Cb 1.17 0.18 -0.26 0.00 -1.52 0.00 0.00 31.29 30.86 3itv h VAL 231 CO 0.48 0.00 0.79 0.52 0.02 0.00 0.00 177.57 179.39 3itv n VAL 232 N -5.51 4.76 0.04 2.57 0.31 -1.26 -4.81 118.33 114.42 3itv n VAL 232 Ca -0.11 -5.40 -0.08 0.00 -0.01 0.00 0.00 64.34 58.73 3itv n VAL 232 Cb 0.41 -2.40 -0.13 0.00 -0.91 0.00 0.00 33.84 30.81 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 6.26 0.03 -3.90 5.55 -0.00 -1.67 -0.44 115.11 120.93 3itv h GLN 233 Ca 0.22 -0.04 -0.25 0.00 -0.00 0.00 0.00 58.65 58.58 3itv h GLN 233 Cb 0.77 0.02 -0.06 0.00 -0.00 0.00 0.00 27.48 28.21 3itv h GLN 233 CO 1.19 0.85 -0.08 0.16 -0.00 0.00 0.00 178.83 180.96 3itv s ASP 234 N -6.54 0.86 0.54 0.06 1.47 -1.26 -2.13 116.67 109.67 3itv s ASP 234 Ca -0.02 -1.49 0.31 0.00 1.18 0.00 0.00 52.55 52.53 3itv s ASP 234 Cb 0.09 0.73 1.55 0.00 -0.34 0.00 0.00 42.92 44.95 3itv s ASP 234 CO 0.83 -1.43 2.09 4.11 0.68 0.00 0.00 175.17 181.44 3itv h TRP 235 N 2.05 0.00 -0.02 2.11 5.08 -1.95 -1.11 115.95 122.11 3itv h TRP 235 Ca -0.29 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.67 3itv h TRP 235 Cb 1.24 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.40 3itv h TRP 235 CO 1.65 0.09 -0.00 0.78 -1.28 0.00 0.00 178.44 179.68 3itv h GLY 236 N 1.01 0.03 1.21 11.11 0.00 -1.99 0.20 103.07 114.64 3itv h GLY 236 Ca -0.00 -0.02 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 3itv h GLY 236 CO 0.01 0.02 0.06 -0.84 0.00 0.00 0.00 176.54 175.79 3itv h THR 237 N -0.29 1.25 -0.71 4.70 2.02 -1.89 -2.15 112.91 115.85 3itv h THR 237 Ca 0.00 -1.03 -0.01 0.00 0.77 0.00 0.00 66.41 66.15 3itv h THR 237 Cb 0.33 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 3itv h THR 237 CO 0.00 0.37 0.40 -1.13 0.37 0.00 0.00 175.52 175.54 3itv h ASN 238 N 0.90 0.87 -0.53 4.18 -0.73 -1.00 -1.07 115.58 118.20 3itv h ASN 238 Ca 0.18 -0.09 -0.01 0.00 1.87 0.00 0.00 56.30 58.25 3itv h ASN 238 Cb 0.45 -0.22 -0.03 0.00 0.27 0.00 0.00 38.32 38.79 3itv h ASN 238 CO 0.02 0.71 0.30 0.22 -0.37 0.00 0.00 177.43 178.30 3itv h TYR 239 N 0.97 0.73 -0.65 0.67 3.20 -0.24 -1.56 116.97 120.09 3itv h TYR 239 Ca 0.25 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.16 3itv h TYR 239 Cb 0.02 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.01 3itv h TYR 239 CO -0.01 0.53 0.43 -0.07 -1.64 0.00 0.00 178.16 177.40 3itv h LEU 240 N 0.71 0.59 0.63 2.82 3.38 -0.75 -0.28 115.31 122.41 3itv h LEU 240 Ca 0.19 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 3itv h LEU 240 Cb 0.04 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.67 3itv h LEU 240 CO -0.03 0.39 -0.30 0.40 0.09 0.00 0.00 178.44 178.99 3itv h ILE 241 N 0.67 0.20 -0.69 1.22 1.08 -0.43 -1.80 117.51 117.76 3itv h ILE 241 Ca 0.28 -0.33 0.08 0.00 -0.39 0.00 0.00 64.86 64.50 3itv h ILE 241 Cb 0.24 0.26 -0.06 0.00 -3.07 0.00 0.00 36.82 34.19 3itv h ILE 241 CO -0.09 0.03 0.36 0.00 -0.69 0.00 0.00 178.15 177.76 3itv h ALA 242 N -0.95 0.95 -0.64 1.87 0.00 -1.00 -0.33 119.26 119.16 3itv h ALA 242 Ca -0.09 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 3itv h ALA 242 Cb 0.69 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3itv h ALA 242 CO 0.14 -0.01 0.04 0.37 0.00 0.00 0.00 179.25 179.80 3itv h GLN 243 N 0.64 1.10 -0.35 0.00 5.75 -1.10 -2.68 115.11 118.46 3itv h GLN 243 Ca 0.33 -0.33 -0.09 0.00 -0.15 0.00 0.00 58.65 58.41 3itv h GLN 243 Cb 0.30 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 3itv h GLN 243 CO -0.23 1.04 -0.14 1.15 -2.65 0.00 0.00 178.83 178.00 3itv h THR 244 N 1.02 1.28 -0.13 2.39 2.02 -0.70 -3.33 112.91 115.46 3itv h THR 244 Ca 0.19 -1.24 -0.04 0.00 0.77 0.00 0.00 66.41 66.08 3itv h THR 244 Cb 0.52 1.34 -0.00 0.00 -1.74 0.00 0.00 68.15 68.27 3itv h THR 244 CO 0.02 0.41 -0.09 -0.07 0.37 0.00 0.00 175.52 176.16 3itv h LEU 245 N 0.51 0.31 0.00 2.58 3.38 -1.04 -3.50 115.31 117.54 3itv h LEU 245 Ca 0.08 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3itv h LEU 245 Cb 0.67 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3itv h LEU 245 CO 0.05 0.69 0.00 0.61 0.09 0.00 0.00 178.44 179.87 3itv n GLY 246 N 0.10 0.90 0.32 0.83 0.00 -1.02 -4.92 105.19 101.41 3itv n GLY 246 Ca -0.06 -1.80 0.16 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.54 132.00 130.29 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 -0.11 1.63 -0.23 0.00 0.00 178.00 179.29 3itv n LYS 248 N -3.87 0.14 -3.50 0.86 5.02 -1.26 -4.80 118.16 110.74 3itv n LYS 248 Ca 0.00 0.10 -0.37 0.00 -2.02 0.00 0.00 58.31 56.03 3itv n LYS 248 Cb 0.26 -1.65 -0.07 0.00 -0.02 0.00 0.00 35.03 33.55 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 -3.06 3.58 0.28 7.82 0.00 -0.58 -0.86 121.76 128.94 3itv s ALA 249 Ca 0.11 -0.50 0.03 0.00 0.00 0.00 0.00 51.96 51.60 3itv s ALA 249 Cb 0.15 -2.46 -0.04 0.00 0.00 0.00 0.00 23.12 20.78 3itv s ALA 249 CO 0.59 -0.03 0.16 -0.65 0.00 0.00 0.00 175.76 175.83 3itv s GLN 250 N 0.74 1.52 -0.11 0.00 -0.21 -0.22 -4.72 119.66 116.65 3itv s GLN 250 Ca 0.17 -1.85 -0.05 0.00 0.02 0.00 0.00 55.36 53.64 3itv s GLN 250 Cb -0.13 0.01 -0.04 0.00 1.00 0.00 0.00 33.01 33.85 3itv s GLN 250 CO 0.05 -0.45 0.08 0.00 -2.12 0.00 0.00 175.29 172.85 3itv s LEU 252 N -0.85 3.30 -0.30 0.00 0.20 -0.31 0.10 118.68 120.82 3itv s LEU 252 Ca 0.13 -0.10 -0.09 0.00 0.69 0.00 0.00 54.13 54.76 3itv s LEU 252 Cb -0.12 -1.80 -0.01 0.00 -0.43 0.00 0.00 46.19 43.84 3itv s LEU 252 CO 0.03 0.18 0.12 -0.69 -0.29 0.00 0.00 176.35 175.70 3itv s VAL 253 N 0.32 4.42 -0.29 1.68 1.01 -0.53 -3.97 120.40 123.04 3itv s VAL 253 Ca -0.03 -0.44 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 3itv s VAL 253 Cb -0.14 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 3itv s VAL 253 CO 0.03 0.11 0.15 -0.62 0.00 0.00 0.00 175.10 174.77 3itv s ASP 254 N 1.59 5.64 0.31 3.32 -1.08 -1.26 -1.21 116.67 123.98 3itv s ASP 254 Ca 0.04 -0.28 0.08 0.00 -0.52 0.00 0.00 52.55 51.88 3itv s ASP 254 Cb -0.17 -2.03 0.85 0.00 -1.46 0.00 0.00 42.92 40.11 3itv s ASP 254 CO 0.05 -0.11 1.72 -0.07 0.52 0.00 0.00 175.17 177.28 3itv h LEU 255 N 8.34 0.59 -0.89 -1.34 3.38 -1.79 -1.96 115.31 121.64 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 1.17 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3itv h LEU 255 CO 0.59 0.08 0.00 0.61 0.09 0.00 0.00 178.44 179.81 3itv n GLY 256 N -1.32 0.30 1.99 0.83 0.00 -1.26 -4.16 105.19 101.58 3itv n GLY 256 Ca 0.26 -0.21 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 3itv n GLY 256 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3itv n HIS 257 N 0.07 2.44 -4.41 1.61 8.25 -0.74 -3.45 115.22 118.98 3itv n HIS 257 Ca 0.06 -1.19 -0.24 0.00 -0.26 0.00 0.00 57.72 56.09 3itv n HIS 257 Cb 0.23 -0.68 -0.10 0.00 1.12 0.00 0.00 29.99 30.56 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 -2.99 2.40 0.79 4.41 3.76 -1.26 -2.52 115.29 119.87 3itv s HIS 258 Ca 0.55 -0.30 -0.13 0.00 -0.15 0.00 0.00 55.06 55.03 3itv s HIS 258 Cb 0.44 -1.07 0.07 0.00 1.11 0.00 0.00 32.58 33.13 3itv s HIS 258 CO 0.14 0.66 1.17 0.00 -0.85 0.00 0.00 174.74 175.85 3itv s ALA 259 N -2.32 1.97 0.28 -1.40 0.00 -1.26 -4.90 121.76 114.12 3itv s ALA 259 Ca 0.29 0.70 -0.30 0.00 0.00 0.00 0.00 51.96 52.65 3itv s ALA 259 Cb -0.06 -3.43 -0.13 0.00 0.00 0.00 0.00 23.12 19.50 3itv s ALA 259 CO 0.15 -2.09 1.28 -2.30 0.00 0.00 0.00 175.76 172.81 3itv n PRO 260 N -3.25 1.88 -0.85 0.00 -0.02 -1.26 -2.12 135.00 129.38 3itv n PRO 260 Ca 0.12 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 3itv n PRO 260 Cb 0.51 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 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 -1.61 -4.70 2.55 3.02 -1.26 -4.99 115.26 109.77 3itv n ASN 261 Ca 0.09 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.23 3itv n ASN 261 Cb 0.33 -1.44 0.01 0.00 -0.61 0.00 0.00 39.78 38.06 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 -2.19 2.36 -2.93 3.41 -1.04 -0.90 -4.90 114.28 108.09 3itv n THR 262 Ca 0.00 -0.50 -0.44 0.00 -2.04 0.00 0.00 64.05 61.07 3itv n THR 262 Cb 0.09 -1.59 -0.03 0.00 -1.82 0.00 0.00 70.33 66.98 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 -0.45 6.37 0.16 8.00 3.84 -1.26 -4.86 114.94 126.73 3itv s ASN 263 Ca 0.59 -1.51 -0.08 0.00 0.21 0.00 0.00 52.86 52.07 3itv s ASN 263 Cb -0.52 -2.39 0.00 0.00 -0.55 0.00 0.00 41.25 37.79 3itv s ASN 263 CO 0.60 -1.23 1.47 0.40 -2.79 0.00 0.00 177.10 175.54 3itv h ILE 264 N 5.90 1.29 0.00 -5.21 2.04 -1.98 -3.07 117.51 116.47 3itv h ILE 264 Ca -0.10 -1.69 -0.02 0.00 1.00 0.00 0.00 64.86 64.05 3itv h ILE 264 Cb 1.05 1.59 -0.00 0.00 -0.74 0.00 0.00 36.82 38.72 3itv h ILE 264 CO 1.14 0.55 -0.10 1.05 0.00 0.00 0.00 178.15 180.78 3itv h GLU 265 N 0.62 0.00 -0.25 2.37 9.09 -1.90 -1.38 114.58 123.13 3itv h GLU 265 Ca 0.03 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.26 3itv h GLU 265 Cb 1.07 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.17 3itv h GLU 265 CO 0.11 0.10 -0.55 1.98 0.05 0.00 0.00 179.01 180.70 3itv h MET 266 N 0.00 0.75 -0.74 1.06 4.05 -1.93 -1.95 114.93 116.17 3itv h MET 266 Ca -0.00 -0.47 0.02 0.00 -0.28 0.00 0.00 59.70 58.97 3itv h MET 266 Cb 0.20 0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 31.02 3itv h MET 266 CO 0.01 1.10 0.47 0.82 0.23 0.00 0.00 176.91 179.54 3itv h ILE 267 N 0.57 1.13 -0.40 1.77 2.04 -1.26 0.88 117.51 122.24 3itv h ILE 267 Ca 0.01 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 65.56 3itv h ILE 267 Cb 1.13 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 3itv h ILE 267 CO 0.11 0.17 0.25 0.58 0.00 0.00 0.00 178.15 179.26 3itv h VAL 268 N 0.93 1.08 -0.61 1.67 2.07 -1.20 -1.30 116.25 118.89 3itv h VAL 268 Ca 0.29 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 3itv h VAL 268 Cb -0.02 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 3itv h VAL 268 CO -0.10 0.09 0.35 0.00 0.02 0.00 0.00 177.57 177.94 3itv h ALA 269 N 1.16 0.78 -0.32 1.67 0.00 -0.54 -1.76 119.26 120.24 3itv h ALA 269 Ca 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3itv h ALA 269 Cb -0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3itv h ALA 269 CO -0.05 0.27 0.17 0.00 0.00 0.00 0.00 179.25 179.64 3itv h ARG 270 N 0.82 0.46 -0.62 0.00 2.47 -0.47 -1.28 114.38 115.76 3itv h ARG 270 Ca 0.22 -0.06 -0.05 0.00 -1.26 0.00 0.00 59.98 58.82 3itv h ARG 270 Cb 0.00 -0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.21 3itv h ARG 270 CO -0.04 0.41 0.18 -0.07 0.56 0.00 0.00 179.97 181.01 3itv h LEU 271 N 0.39 0.88 -0.43 3.04 3.38 -1.09 -2.56 115.31 118.92 3itv h LEU 271 Ca 0.11 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3itv h LEU 271 Cb 0.09 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 3itv h LEU 271 CO -0.02 0.83 0.12 0.40 0.09 0.00 0.00 178.44 179.86 3itv h ILE 272 N 0.91 1.23 -0.66 1.22 2.04 -1.05 0.14 117.51 121.32 3itv h ILE 272 Ca 0.20 -0.77 0.07 0.00 1.00 0.00 0.00 64.86 65.37 3itv h ILE 272 Cb 0.28 0.92 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 3itv h ILE 272 CO -0.01 0.27 0.44 -0.61 0.00 0.00 0.00 178.15 178.24 3itv h GLN 273 N 0.55 0.61 -0.55 2.37 4.15 -0.89 -1.33 115.11 120.03 3itv h GLN 273 Ca 0.14 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.52 3itv h GLN 273 Cb 0.29 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.84 3itv h GLN 273 CO -0.00 0.41 0.00 1.19 -1.93 0.00 0.00 178.83 178.49 3itv n PHE 274 N -4.48 1.86 -2.47 3.99 3.72 -1.00 -4.95 117.46 114.13 3itv n PHE 274 Ca 0.10 -0.73 -0.19 0.00 -0.05 0.00 0.00 57.45 56.58 3itv n PHE 274 Cb 0.26 -0.45 -0.01 0.00 -0.94 0.00 0.00 39.48 38.35 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 0.55 -0.50 0.07 1.37 0.00 -0.50 -4.90 105.19 101.28 3itv n GLY 275 Ca 0.27 0.01 0.09 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 -3.06 1.35 -2.88 1.61 4.76 0.41 -4.94 118.16 115.41 3itv n LYS 276 Ca -0.21 -2.52 -0.43 0.00 -2.87 0.00 0.00 58.31 52.27 3itv n LYS 276 Cb 0.67 -1.47 -0.04 0.00 -1.84 0.00 0.00 35.03 32.35 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 -2.77 4.49 0.03 -0.35 2.96 -1.20 -0.21 118.68 121.63 3itv s LEU 277 Ca 0.30 -1.08 -0.18 0.00 -0.22 0.00 0.00 54.13 52.96 3itv s LEU 277 Cb 0.27 -2.41 -0.24 0.00 0.50 0.00 0.00 46.19 44.31 3itv s LEU 277 CO 0.03 -1.40 1.12 1.23 -1.32 0.00 0.00 176.35 176.01 3itv h GLY 278 N 11.21 0.58 0.00 7.98 0.00 -0.63 -3.42 103.07 118.78 3itv h GLY 278 Ca -0.27 -1.04 0.00 0.00 0.00 0.00 0.00 47.33 46.03 3itv h GLY 278 CO 1.17 0.92 0.00 0.61 0.00 0.00 0.00 176.54 179.24 3itv n GLY 279 N 1.12 -1.28 3.27 4.60 0.00 -1.16 -1.02 105.19 110.72 3itv n GLY 279 Ca -0.11 -0.90 -0.17 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.80 1.44 -0.31 1.61 0.40 0.42 -1.45 117.98 117.29 3itv s PHE 280 Ca 0.00 -0.62 0.02 0.00 -0.60 0.00 0.00 56.93 55.72 3itv s PHE 280 Cb 0.00 -0.72 0.09 0.00 0.51 0.00 0.00 43.02 42.90 3itv s PHE 280 CO 0.00 0.18 0.05 -1.01 0.70 0.00 0.00 175.22 175.14 3itv s HIS 281 N -2.73 2.80 0.23 0.36 3.76 -0.35 -1.67 115.29 117.70 3itv s HIS 281 Ca 0.15 -2.35 -0.25 0.00 -0.15 0.00 0.00 55.06 52.46 3itv s HIS 281 Cb -0.01 -2.28 -0.09 0.00 1.11 0.00 0.00 32.58 31.31 3itv s HIS 281 CO 0.03 -0.90 0.83 -0.06 -0.85 0.00 0.00 174.74 173.79 3itv s PHE 282 N 1.24 3.79 0.00 1.40 0.08 0.14 -2.40 117.98 122.23 3itv s PHE 282 Ca 0.08 1.65 0.00 0.00 0.12 0.00 0.00 56.93 58.78 3itv s PHE 282 Cb -0.18 -2.80 0.00 0.00 -0.57 0.00 0.00 43.02 39.47 3itv s PHE 282 CO -0.14 0.37 0.00 0.27 -0.10 0.00 0.00 175.22 175.62 3itv n ASN 283 N 1.05 0.00 -4.38 1.36 0.23 -1.26 -1.25 115.26 111.01 3itv n ASN 283 Ca -0.02 0.00 -0.19 0.00 -0.53 0.00 0.00 54.58 53.84 3itv n ASN 283 Cb 0.49 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.09 3itv n ASN 283 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3itv s ASP 284 N 0.00 2.21 0.09 0.53 -1.08 0.45 -4.60 116.67 114.28 3itv s ASP 284 Ca 0.00 -1.23 -0.26 0.00 -0.52 0.00 0.00 52.55 50.53 3itv s ASP 284 Cb 0.00 -0.06 0.08 0.00 -1.46 0.00 0.00 42.92 41.48 3itv s ASP 284 CO 0.00 -0.47 0.86 -0.94 0.52 0.00 0.00 175.17 175.13 3itv s SER 285 N -3.38 -0.32 0.00 -0.34 1.04 -1.26 -1.07 113.70 108.37 3itv s SER 285 Ca 0.30 -0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.55 3itv s SER 285 Cb 0.06 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.65 3itv s SER 285 CO 0.11 -0.82 0.00 1.17 0.98 0.00 0.00 173.24 174.67 3itv n LYS 286 N -0.36 1.66 -0.01 4.02 4.81 -1.26 -4.76 118.16 122.27 3itv n LYS 286 Ca -0.09 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.31 3itv n LYS 286 Cb 0.62 -0.77 -0.01 0.00 0.02 0.00 0.00 35.03 34.88 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 -1.49 0.00 0.00 5.64 4.01 -1.26 -5.10 117.16 118.96 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 0.27 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.10 3itv n TYR 287 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3itv n GLY 288 N 2.74 5.33 2.72 2.72 0.00 -1.26 -4.92 105.19 112.53 3itv n GLY 288 Ca -0.08 -0.92 -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 5.78 0.28 1.61 2.03 -1.22 -4.73 116.55 120.29 3itv n ASP 289 Ca 0.00 -3.04 0.16 0.00 0.52 0.00 0.00 54.79 52.43 3itv n ASP 289 Cb 0.00 -1.49 0.81 0.00 -0.72 0.00 0.00 41.12 39.73 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 5.49 0.00 -5.79 1.67 3.32 -1.83 -3.47 116.42 115.81 3itv h ASP 290 Ca 0.52 0.00 -0.44 0.00 0.02 0.00 0.00 57.03 57.13 3itv h ASP 290 Cb 0.54 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 3itv h ASP 290 CO 1.65 0.07 -0.68 0.47 -1.72 0.00 0.00 179.24 179.03 3itv n ASP 291 N -3.37 -4.95 -4.90 6.45 8.00 -1.23 -4.83 116.55 111.72 3itv n ASP 291 Ca -0.01 -0.60 -0.29 0.00 0.71 0.00 0.00 54.79 54.60 3itv n ASP 291 Cb 0.23 -3.98 0.05 0.00 -0.02 0.00 0.00 41.12 37.40 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 2.91 0.14 0.64 1.43 -0.23 -1.86 118.68 114.68 3itv s LEU 292 Ca 0.55 0.90 -0.35 0.00 -1.03 0.00 0.00 54.13 54.20 3itv s LEU 292 Cb -0.27 -3.64 -0.15 0.00 0.03 0.00 0.00 46.19 42.16 3itv s LEU 292 CO 0.68 -1.39 1.51 0.47 0.23 0.00 0.00 176.35 177.84 3itv n ASP 293 N -2.94 2.64 -4.62 2.29 9.92 -1.26 -0.41 116.55 122.16 3itv n ASP 293 Ca 0.07 1.09 -0.47 0.00 -0.53 0.00 0.00 54.79 54.95 3itv n ASP 293 Cb 0.58 -1.35 -0.03 0.00 -0.64 0.00 0.00 41.12 39.68 3itv n ASP 293 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3itv n ALA 294 N 3.16 0.13 -0.81 2.24 0.00 -1.26 -1.80 120.51 122.16 3itv n ALA 294 Ca 0.17 0.44 0.00 0.00 0.00 0.00 0.00 53.44 54.05 3itv n ALA 294 Cb 0.26 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.56 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 2.07 0.49 0.21 0.00 0.00 -1.26 -4.76 105.19 101.93 3itv n GLY 295 Ca 0.13 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.29 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 -1.72 -3.29 119.26 119.86 3itv h ALA 296 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3itv h ALA 296 Cb 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3itv h ALA 296 CO 0.00 0.00 -1.47 -0.89 0.00 0.00 0.00 179.25 176.89 3itv n ILE 297 N -2.86 0.63 -3.59 0.00 2.08 -1.26 -4.92 119.36 109.44 3itv n ILE 297 Ca 0.03 -0.10 -0.27 0.00 0.56 0.00 0.00 62.75 62.96 3itv n ILE 297 Cb 0.41 -1.66 -0.11 0.00 -0.75 0.00 0.00 39.64 37.54 3itv n ILE 297 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3itv n GLU 298 N -3.50 0.94 0.19 0.38 1.02 -1.26 -4.97 120.64 113.45 3itv n GLU 298 Ca -0.19 -3.75 0.06 0.00 -0.02 0.00 0.00 57.16 53.26 3itv n GLU 298 Cb 0.60 -1.92 0.53 0.00 -0.02 0.00 0.00 31.44 30.64 3itv n GLU 298 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3itv h PRO 299 N 5.41 0.10 -0.45 3.49 0.13 -1.92 -2.79 132.00 135.99 3itv h PRO 299 Ca 0.21 -0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 65.21 3itv h PRO 299 Cb 0.84 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 3itv h PRO 299 CO 0.53 0.16 -0.19 -0.92 -0.23 0.00 0.00 178.00 177.35 3itv h TYR 300 N 0.10 1.00 -0.89 1.56 3.20 -1.93 -2.23 116.97 117.78 3itv h TYR 300 Ca 0.02 -0.22 -0.01 0.00 3.14 0.00 0.00 58.73 61.66 3itv h TYR 300 Cb 0.16 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 3itv h TYR 300 CO 0.00 0.99 0.52 -0.09 -1.64 0.00 0.00 178.16 177.95 3itv h ARG 301 N 0.77 1.23 -0.61 1.82 2.43 -1.93 0.54 114.38 118.63 3itv h ARG 301 Ca 0.11 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 3itv h ARG 301 Cb 0.73 -0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 3itv h ARG 301 CO 0.06 0.87 0.36 1.25 -1.51 0.00 0.00 179.97 181.00 3itv h LEU 302 N 1.24 0.75 -0.68 3.80 5.85 -1.42 -1.09 115.31 123.75 3itv h LEU 302 Ca 0.32 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 3itv h LEU 302 Cb -0.02 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 3itv h LEU 302 CO -0.06 0.60 0.34 0.15 -0.34 0.00 0.00 178.44 179.14 3itv h PHE 303 N 0.83 0.96 0.00 1.25 3.57 -0.77 -2.08 116.94 120.70 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 0.00 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 3itv h PHE 303 CO -0.02 0.71 -0.24 -0.07 -2.23 0.00 0.00 178.31 176.46 3itv h LEU 304 N 0.94 0.00 -0.16 0.59 3.38 -0.26 0.21 115.31 120.01 3itv h LEU 304 Ca 0.23 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.12 3itv h LEU 304 Cb 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3itv h LEU 304 CO -0.03 0.24 -0.22 0.58 0.09 0.00 0.00 178.44 179.09 3itv h VAL 305 N 0.00 1.35 0.00 1.22 2.07 -0.83 -2.88 116.25 117.18 3itv h VAL 305 Ca -0.00 -1.43 -0.04 0.00 0.82 0.00 0.00 66.70 66.04 3itv h VAL 305 Cb 0.43 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 3itv h VAL 305 CO 0.03 0.43 -0.20 -0.26 0.02 0.00 0.00 177.57 177.59 3itv h PHE 306 N 0.07 0.00 -0.49 1.57 0.04 -0.75 -1.93 116.94 115.46 3itv h PHE 306 Ca 0.02 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.74 3itv h PHE 306 Cb 0.79 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.92 3itv h PHE 306 CO 0.09 0.20 0.09 -0.97 -0.60 0.00 0.00 178.31 177.12 3itv h ASN 307 N 0.00 0.71 0.16 2.17 -1.24 -0.40 0.18 115.58 117.16 3itv h ASN 307 Ca -0.00 -0.13 -0.18 0.00 0.71 0.00 0.00 56.30 56.70 3itv h ASN 307 Cb 0.52 -0.18 -0.00 0.00 0.73 0.00 0.00 38.32 39.38 3itv h ASN 307 CO 0.03 0.72 -0.69 -0.33 -1.29 0.00 0.00 177.43 175.87 3itv h GLU 308 N 0.73 0.47 -0.41 6.67 4.39 -1.17 -0.60 114.58 124.65 3itv h GLU 308 Ca 0.16 -0.36 -0.06 0.00 0.34 0.00 0.00 59.36 59.43 3itv h GLU 308 Cb 0.31 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 3itv h GLU 308 CO 0.00 0.99 0.01 -0.07 -1.16 0.00 0.00 179.01 178.78 3itv h LEU 309 N 0.33 0.70 -0.68 1.33 3.38 -0.95 -1.95 115.31 117.49 3itv h LEU 309 Ca -0.02 -0.30 -0.14 0.00 0.09 0.00 0.00 57.88 57.50 3itv h LEU 309 Cb 1.26 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 3itv h LEU 309 CO 0.12 0.83 -0.59 0.58 0.09 0.00 0.00 178.44 179.48 3itv h VAL 310 N 0.55 1.38 -0.26 1.22 2.07 -0.96 -2.86 116.25 117.39 3itv h VAL 310 Ca 0.12 -1.94 -0.05 0.00 0.82 0.00 0.00 66.70 65.64 3itv h VAL 310 Cb 0.47 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 3itv h VAL 310 CO 0.02 0.57 -0.07 -0.78 0.02 0.00 0.00 177.57 177.34 3itv h ASP 311 N 0.18 0.39 -0.91 0.57 3.58 -0.88 -1.42 116.42 117.94 3itv h ASP 311 Ca -0.00 -0.08 0.03 0.00 0.42 0.00 0.00 57.03 57.40 3itv h ASP 311 Cb 1.08 -0.10 -0.05 0.00 1.72 0.00 0.00 39.33 41.98 3itv h ASP 311 CO 0.09 0.50 0.59 0.00 -2.88 0.00 0.00 179.24 177.55 3itv h ALA 312 N 1.55 1.19 -0.39 -0.78 0.00 -1.12 0.27 119.26 119.98 3itv h ALA 312 Ca 0.08 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 3itv h ALA 312 Cb 0.37 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3itv h ALA 312 CO 0.02 0.47 -0.29 1.49 0.00 0.00 0.00 179.25 180.95 3itv h GLU 313 N 1.17 0.84 -0.07 0.00 4.81 -1.38 -1.62 114.58 118.32 3itv h GLU 313 Ca 0.36 -0.38 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 3itv h GLU 313 Cb -0.03 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 3itv h GLU 313 CO -0.11 1.01 -0.26 0.00 -0.73 0.00 0.00 179.01 178.92 3itv h ALA 314 N 0.96 1.43 -0.01 2.92 0.00 -0.16 -1.90 119.26 122.50 3itv h ALA 314 Ca 0.08 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3itv h ALA 314 Cb 0.83 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3itv h ALA 314 CO 0.07 0.41 -0.03 0.54 0.00 0.00 0.00 179.25 180.24 3itv n ARG 315 N -4.18 1.27 -2.52 0.00 1.74 0.82 -4.94 116.66 108.85 3itv n ARG 315 Ca -0.01 -0.53 -0.09 0.00 -0.77 0.00 0.00 57.85 56.44 3itv n ARG 315 Cb 0.34 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.31 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 1.14 0.15 3.71 -0.13 0.00 -0.71 -4.98 105.19 104.38 3itv n GLY 316 Ca 0.20 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.75 2.96 0.24 1.61 1.01 -0.64 -4.99 120.40 117.85 3itv s VAL 317 Ca 0.11 0.66 -0.11 0.00 0.00 0.00 0.00 61.98 62.64 3itv s VAL 317 Cb -0.05 -3.42 -0.08 0.00 0.00 0.00 0.00 36.38 32.83 3itv s VAL 317 CO 0.14 0.04 0.58 -0.54 0.00 0.00 0.00 175.10 175.32 3itv s LYS 318 N 1.33 3.84 -1.55 2.72 -0.14 -1.26 -4.27 119.74 120.41 3itv s LYS 318 Ca 0.68 0.35 -0.04 0.00 -1.36 0.00 0.00 55.97 55.60 3itv s LYS 318 Cb -0.40 -2.62 0.01 0.00 -1.68 0.00 0.00 37.83 33.14 3itv s LYS 318 CO 0.31 0.29 0.39 0.41 -0.76 0.00 0.00 175.35 175.99 3itv n GLY 319 N -0.15 -0.51 3.33 -3.33 0.00 -1.26 -4.95 105.19 98.32 3itv n GLY 319 Ca 0.01 0.08 -0.46 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.07 3.20 -0.45 1.61 5.36 -1.26 -4.93 117.98 118.45 3itv s PHE 320 Ca 0.21 -1.18 0.09 0.00 -0.96 0.00 0.00 56.93 55.08 3itv s PHE 320 Cb -0.10 -3.77 0.30 0.00 -0.34 0.00 0.00 43.02 39.12 3itv s PHE 320 CO 0.26 -1.04 0.70 0.72 -1.46 0.00 0.00 175.22 174.39 3itv n HIS 321 N 5.44 1.12 -1.81 10.12 8.25 -1.26 -5.10 115.22 131.98 3itv n HIS 321 Ca -0.13 -3.81 -0.40 0.00 -0.26 0.00 0.00 57.72 53.12 3itv n HIS 321 Cb 0.41 -0.43 0.02 0.00 1.12 0.00 0.00 29.99 31.11 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 -2.18 3.67 0.08 -0.41 0.04 -1.26 -4.97 135.00 129.97 3itv s PRO 322 Ca 0.40 2.40 -0.26 0.00 0.04 0.00 0.00 61.00 63.57 3itv s PRO 322 Cb 0.25 -2.64 -0.06 0.00 0.04 0.00 0.00 34.50 32.09 3itv s PRO 322 CO -0.09 -0.82 0.82 0.00 0.04 0.00 0.00 177.00 176.95 3itv s ALA 323 N -1.21 3.35 -0.18 8.56 0.00 -0.19 -4.92 121.76 127.17 3itv s ALA 323 Ca 0.61 0.37 -0.03 0.00 0.00 0.00 0.00 51.96 52.91 3itv s ALA 323 Cb -0.43 -3.06 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 3itv s ALA 323 CO 0.55 0.07 -0.05 -1.01 0.00 0.00 0.00 175.76 175.33 3itv s HIS 324 N -0.19 2.97 -0.01 0.00 3.76 -1.26 -0.44 115.29 120.12 3itv s HIS 324 Ca 0.40 -0.55 -0.06 0.00 -0.15 0.00 0.00 55.06 54.70 3itv s HIS 324 Cb -0.22 -2.00 0.00 0.00 1.11 0.00 0.00 32.58 31.48 3itv s HIS 324 CO 0.25 -0.24 0.12 -1.64 -0.85 0.00 0.00 174.74 172.38 3itv s MET 325 N 0.76 0.38 -0.13 1.40 -1.94 -0.67 -0.81 119.30 118.29 3itv s MET 325 Ca -0.02 -0.26 -0.14 0.00 -1.71 0.00 0.00 55.69 53.56 3itv s MET 325 Cb -0.15 0.16 -0.05 0.00 2.01 0.00 0.00 34.83 36.81 3itv s MET 325 CO 0.02 -0.08 0.31 0.42 -0.01 0.00 0.00 175.02 175.68 3itv s ILE 326 N -1.00 5.27 -0.38 2.53 1.01 -0.12 0.28 121.20 128.79 3itv s ILE 326 Ca -0.11 0.60 0.01 0.00 0.00 0.00 0.00 60.65 61.15 3itv s ILE 326 Cb -0.06 -3.64 0.12 0.00 0.01 0.00 0.00 42.46 38.89 3itv s ILE 326 CO 0.01 0.43 0.18 -0.62 0.00 0.00 0.00 174.94 174.94 3itv s ASP 327 N 0.15 3.78 0.13 3.58 -1.08 -0.38 -3.77 116.67 119.09 3itv s ASP 327 Ca 0.18 -2.23 0.01 0.00 -0.52 0.00 0.00 52.55 50.00 3itv s ASP 327 Cb -0.14 -0.95 -0.04 0.00 -1.46 0.00 0.00 42.92 40.33 3itv s ASP 327 CO 0.06 -0.33 -0.02 -1.10 0.52 0.00 0.00 175.17 174.30 3itv s GLN 328 N 0.87 0.96 -0.05 4.34 -0.21 -1.26 -4.53 119.66 119.79 3itv s GLN 328 Ca 0.15 -1.44 0.03 0.00 0.02 0.00 0.00 55.36 54.12 3itv s GLN 328 Cb -0.22 -0.16 0.00 0.00 1.00 0.00 0.00 33.01 33.64 3itv s GLN 328 CO -0.09 -0.10 -0.13 0.15 -2.12 0.00 0.00 175.29 172.99 3itv s LYS 329 N -3.90 1.53 -0.38 2.91 3.01 -0.78 -4.37 119.74 117.76 3itv s LYS 329 Ca 0.19 -0.46 -0.02 0.00 -1.01 0.00 0.00 55.97 54.67 3itv s LYS 329 Cb 0.06 -1.33 0.10 0.00 -1.01 0.00 0.00 37.83 35.65 3itv s LYS 329 CO -0.00 0.13 0.15 -1.01 0.51 0.00 0.00 175.35 175.13 3itv s HIS 330 N 0.31 3.55 -0.13 3.18 3.76 -1.26 -4.62 115.29 120.07 3itv s HIS 330 Ca -0.08 -2.36 0.18 0.00 -0.15 0.00 0.00 55.06 52.66 3itv s HIS 330 Cb -0.12 -3.00 -0.15 0.00 1.11 0.00 0.00 32.58 30.42 3itv s HIS 330 CO 0.02 -0.94 0.73 0.09 -0.85 0.00 0.00 174.74 173.80 3itv n ASN 331 N 4.57 0.69 -0.64 1.40 3.02 -1.26 -0.84 115.26 122.20 3itv n ASN 331 Ca -0.04 0.30 0.04 0.00 -0.03 0.00 0.00 54.58 54.85 3itv n ASN 331 Cb 0.42 0.46 0.07 0.00 -0.61 0.00 0.00 39.78 40.11 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 -2.79 0.77 -4.16 2.41 0.24 -1.26 -4.74 118.33 108.80 3itv n VAL 332 Ca -0.11 -1.24 -0.12 0.00 -2.04 0.00 0.00 64.34 60.84 3itv n VAL 332 Cb 0.82 0.33 -0.09 0.00 -1.47 0.00 0.00 33.84 33.43 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 -1.16 0.00 -0.23 3.34 -4.23 -1.26 -5.10 115.64 107.00 3itv s THR 333 Ca 0.21 -1.86 -0.29 0.00 -1.18 0.00 0.00 61.69 58.57 3itv s THR 333 Cb 0.21 -2.44 -0.01 0.00 1.34 0.00 0.00 72.50 71.60 3itv s THR 333 CO -0.04 0.00 1.35 -0.62 -0.54 0.00 0.00 174.62 174.77 3itv s ASP 334 N -3.15 6.72 0.33 3.99 -1.08 -1.26 -4.89 116.67 117.32 3itv s ASP 334 Ca 0.35 1.47 0.11 0.00 -0.52 0.00 0.00 52.55 53.96 3itv s ASP 334 Cb 0.05 -2.54 0.91 0.00 -1.46 0.00 0.00 42.92 39.88 3itv s ASP 334 CO 0.13 -1.00 1.74 -0.65 0.52 0.00 0.00 175.17 175.91 3itv h PRO 335 N 9.16 0.55 -0.45 4.34 0.11 -1.87 -1.08 132.00 142.77 3itv h PRO 335 Ca -0.28 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.76 3itv h PRO 335 Cb 1.11 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 3itv h PRO 335 CO 1.00 0.36 0.15 0.82 -0.21 0.00 0.00 178.00 180.12 3itv h ILE 336 N 0.56 1.22 -0.58 4.15 2.04 -1.87 -1.15 117.51 121.89 3itv h ILE 336 Ca 0.63 -0.72 -0.06 0.00 1.00 0.00 0.00 64.86 65.71 3itv h ILE 336 Cb 1.25 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 3itv h ILE 336 CO -0.44 0.26 0.11 -0.33 0.00 0.00 0.00 178.15 177.75 3itv h GLU 337 N 0.59 0.95 -0.60 2.37 5.08 -1.63 -1.15 114.58 120.19 3itv h GLU 337 Ca 0.15 -0.25 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 3itv h GLU 337 Cb 0.26 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3itv h GLU 337 CO -0.01 0.89 0.09 0.77 -1.00 0.00 0.00 179.01 179.75 3itv h SER 338 N 0.85 0.96 -0.15 1.42 0.02 -1.18 -1.55 113.55 113.92 3itv h SER 338 Ca 0.18 -0.27 -0.09 0.00 -0.84 0.00 0.00 61.79 60.77 3itv h SER 338 Cb 0.39 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 3itv h SER 338 CO 0.01 0.99 -0.19 -0.07 -1.14 0.00 0.00 176.83 176.43 3itv h LEU 339 N 0.90 0.56 0.42 5.07 3.38 -1.06 0.08 115.31 124.65 3itv h LEU 339 Ca 0.18 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3itv h LEU 339 Cb 0.44 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3itv h LEU 339 CO 0.01 0.76 -0.20 0.40 0.09 0.00 0.00 178.44 179.50 3itv h ILE 340 N 0.51 0.59 0.00 1.22 2.04 -0.87 -1.06 117.51 119.93 3itv h ILE 340 Ca 0.08 -0.17 -0.05 0.00 1.00 0.00 0.00 64.86 65.72 3itv h ILE 340 Cb 0.61 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 3itv h ILE 340 CO 0.04 0.03 -0.22 0.78 0.00 0.00 0.00 178.15 178.78 3itv h ASN 341 N -0.66 0.00 -0.11 1.72 4.21 -1.20 -1.70 115.58 117.84 3itv h ASN 341 Ca -0.06 0.00 -0.18 0.00 1.21 0.00 0.00 56.30 57.27 3itv h ASN 341 Cb 0.48 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.69 3itv h ASN 341 CO 0.09 0.22 -0.64 0.28 -1.29 0.00 0.00 177.43 176.09 3itv h SER 342 N 0.00 0.76 -0.47 5.81 0.02 -0.84 -0.40 113.55 118.43 3itv h SER 342 Ca -0.00 -0.65 -0.06 0.00 -0.84 0.00 0.00 61.79 60.24 3itv h SER 342 Cb 0.63 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 3itv h SER 342 CO 0.03 1.29 0.09 0.00 -1.14 0.00 0.00 176.83 177.10 3itv h ALA 343 N 0.49 1.17 -0.43 3.77 0.00 -0.97 -1.33 119.26 121.95 3itv h ALA 343 Ca -0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 3itv h ALA 343 Cb 1.29 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 3itv h ALA 343 CO 0.13 0.56 0.16 -0.91 0.00 0.00 0.00 179.25 179.19 3itv h ASN 344 N 0.79 0.61 -0.32 0.00 -0.26 -1.18 -1.96 115.58 113.26 3itv h ASN 344 Ca 0.17 -0.18 -0.04 0.00 -0.56 0.00 0.00 56.30 55.69 3itv h ASN 344 Cb 0.35 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.43 3itv h ASN 344 CO 0.01 0.63 0.08 -0.08 -1.06 0.00 0.00 177.43 177.01 3itv h GLU 345 N 0.56 0.60 -0.34 0.81 4.57 -0.58 0.35 114.58 120.54 3itv h GLU 345 Ca 0.14 -0.11 -0.08 0.00 -1.18 0.00 0.00 59.36 58.13 3itv h GLU 345 Cb 0.22 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 3itv h GLU 345 CO -0.01 0.56 -0.11 0.82 -1.18 0.00 0.00 179.01 179.09 3itv h ILE 346 N 0.58 1.28 0.00 2.32 2.04 -0.97 -1.46 117.51 121.30 3itv h ILE 346 Ca 0.13 -1.20 -0.07 0.00 1.00 0.00 0.00 64.86 64.73 3itv h ILE 346 Cb 0.25 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 3itv h ILE 346 CO -0.00 0.39 -0.33 0.03 0.00 0.00 0.00 178.15 178.24 3itv h ARG 347 N 0.47 0.00 -0.05 2.37 3.08 -0.92 -1.78 114.38 117.55 3itv h ARG 347 Ca 0.08 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 3itv h ARG 347 Cb 0.63 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 3itv h ARG 347 CO 0.04 0.33 0.00 -0.09 -1.07 0.00 0.00 179.97 179.18 3itv h ARG 348 N 0.00 0.08 -0.78 0.04 2.43 -0.49 0.71 114.38 116.37 3itv h ARG 348 Ca -0.00 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 3itv h ARG 348 Cb 0.60 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 3itv h ARG 348 CO 0.04 0.34 0.32 0.00 -1.51 0.00 0.00 179.97 179.16 3itv h ALA 349 N 0.74 1.10 -0.09 2.80 0.00 -1.12 -1.26 119.26 121.43 3itv h ALA 349 Ca 0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 3itv h ALA 349 Cb 0.30 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3itv h ALA 349 CO 0.00 0.65 0.04 -0.92 0.00 0.00 0.00 179.25 179.02 3itv h TYR 350 N 1.13 0.14 -0.53 0.00 3.20 -1.18 -0.85 116.97 118.87 3itv h TYR 350 Ca 0.26 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.16 3itv h TYR 350 Cb 0.20 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.38 3itv h TYR 350 CO 0.02 0.23 0.30 0.00 -1.64 0.00 0.00 178.16 177.07 3itv h ALA 351 N 0.89 0.69 -0.75 1.82 0.00 -0.61 -1.48 119.26 119.83 3itv h ALA 351 Ca 0.03 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3itv h ALA 351 Cb 0.15 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3itv h ALA 351 CO -0.00 -0.02 0.31 1.96 0.00 0.00 0.00 179.25 181.50 3itv h GLN 352 N 0.58 1.10 -0.26 0.00 4.20 -1.06 -1.88 115.11 117.80 3itv h GLN 352 Ca 0.23 -0.18 -0.04 0.00 0.06 0.00 0.00 58.65 58.72 3itv h GLN 352 Cb 0.08 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 3itv h GLN 352 CO -0.13 0.88 -0.00 0.00 -0.67 0.00 0.00 178.83 178.90 3itv h ALA 353 N 1.26 1.52 0.00 3.87 0.00 -0.40 -1.38 119.26 124.14 3itv h ALA 353 Ca 0.25 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3itv h ALA 353 Cb 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3itv h ALA 353 CO -0.02 0.35 -0.15 -0.07 0.00 0.00 0.00 179.25 179.36 3itv h LEU 354 N 0.37 0.00 -0.14 0.00 3.38 -0.48 -2.97 115.31 115.48 3itv h LEU 354 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3itv h LEU 354 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3itv h LEU 354 CO 0.01 0.15 0.00 -0.07 0.09 0.00 0.00 178.44 178.61 3itv h LEU 355 N 0.00 0.00 -9.48 1.67 3.38 -0.92 -3.46 115.31 106.50 3itv h LEU 355 Ca -0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 3itv h LEU 355 Cb 0.60 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.40 3itv h LEU 355 CO 0.02 0.00 0.86 0.52 0.09 0.00 0.00 178.44 179.93 3itv n VAL 356 N -2.93 0.09 -2.59 1.22 0.31 -1.12 -4.82 118.33 108.49 3itv n VAL 356 Ca 0.04 -0.02 -0.41 0.00 -0.01 0.00 0.00 64.34 63.94 3itv n VAL 356 Cb 0.49 -1.62 -0.03 0.00 -0.91 0.00 0.00 33.84 31.77 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 1.40 6.41 0.50 4.52 -1.08 -1.26 -4.82 116.67 122.34 3itv s ASP 357 Ca 0.81 -1.21 0.30 0.00 -0.52 0.00 0.00 52.55 51.92 3itv s ASP 357 Cb -0.67 -2.55 1.06 0.00 -1.46 0.00 0.00 42.92 39.30 3itv s ASP 357 CO 0.39 -1.57 1.87 0.03 0.52 0.00 0.00 175.17 176.42 3itv h ARG 358 N 9.79 0.00 -0.21 4.34 3.08 -1.96 0.01 114.38 129.44 3itv h ARG 358 Ca 0.06 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.02 3itv h ARG 358 Cb 1.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.07 3itv h ARG 358 CO 1.36 0.00 -0.21 0.00 -1.07 0.00 0.00 179.97 180.06 3itv h ALA 359 N 2.02 0.30 -0.34 0.04 0.00 -2.00 -0.84 119.26 118.45 3itv h ALA 359 Ca 0.00 -0.36 -0.12 0.00 0.00 0.00 0.00 54.91 54.43 3itv h ALA 359 Cb 0.64 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3itv h ALA 359 CO 0.00 0.24 -0.26 0.00 0.00 0.00 0.00 179.25 179.23 3itv h ALA 360 N 0.65 0.49 -0.63 0.00 0.00 -1.91 -2.89 119.26 114.97 3itv h ALA 360 Ca 0.03 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.56 3itv h ALA 360 Cb 0.75 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 3itv h ALA 360 CO 0.05 0.49 0.41 1.25 0.00 0.00 0.00 179.25 181.45 3itv h LEU 361 N 0.56 0.70 -1.24 0.00 5.85 -0.95 -1.56 115.31 118.67 3itv h LEU 361 Ca 0.06 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3itv h LEU 361 Cb 0.83 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.65 3itv h LEU 361 CO 0.07 0.50 0.46 0.77 -0.34 0.00 0.00 178.44 179.90 3itv h SER 362 N 0.83 0.86 -0.28 1.25 4.64 -1.10 -0.40 113.55 119.35 3itv h SER 362 Ca 0.24 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.47 3itv h SER 362 Cb -0.06 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 61.80 3itv h SER 362 CO -0.07 0.64 -0.03 1.23 -0.87 0.00 0.00 176.83 177.73 3itv h GLY 363 N 1.02 0.56 1.82 -0.77 0.00 -1.18 -1.61 103.07 102.91 3itv h GLY 363 Ca 0.27 -0.44 -0.06 0.00 0.00 0.00 0.00 47.33 47.10 3itv h GLY 363 CO -0.05 0.40 -0.17 -0.97 0.00 0.00 0.00 176.54 175.75 3itv h TYR 364 N 0.29 0.23 -0.21 5.60 0.05 -0.81 -1.70 116.97 120.42 3itv h TYR 364 Ca 0.07 -0.03 -0.12 0.00 0.05 0.00 0.00 58.73 58.71 3itv h TYR 364 Cb 0.49 -0.06 -0.00 0.00 1.01 0.00 0.00 36.73 38.16 3itv h TYR 364 CO 0.04 0.39 -0.33 1.96 -1.05 0.00 0.00 178.16 179.17 3itv h GLN 365 N 0.21 0.60 -0.68 4.88 4.20 -0.92 0.43 115.11 123.82 3itv h GLN 365 Ca 0.04 -0.36 0.01 0.00 0.06 0.00 0.00 58.65 58.40 3itv h GLN 365 Cb 0.43 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.21 3itv h GLN 365 CO 0.03 0.97 0.45 0.93 -0.67 0.00 0.00 178.83 180.53 3itv h GLU 366 N 0.28 0.88 -0.18 1.46 5.08 -0.95 -2.38 114.58 118.76 3itv h GLU 366 Ca 0.02 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3itv h GLU 366 Cb 0.92 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.97 3itv h GLU 366 CO 0.08 0.58 0.00 -0.25 -1.00 0.00 0.00 179.01 178.42 3itv n ASP 367 N -4.63 1.29 -3.82 1.42 8.00 -0.67 -4.92 116.55 113.22 3itv n ASP 367 Ca 0.06 -1.79 -0.28 0.00 0.71 0.00 0.00 54.79 53.49 3itv n ASP 367 Cb 0.03 -0.12 0.04 0.00 -0.02 0.00 0.00 41.12 41.06 3itv n ASP 367 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3itv n ASN 368 N 0.12 -4.93 -4.32 -2.24 4.13 -0.83 -4.89 115.26 102.31 3itv n ASN 368 Ca 0.12 -0.72 -0.44 0.00 1.68 0.00 0.00 54.58 55.22 3itv n ASN 368 Cb 0.24 -4.20 0.00 0.00 -1.54 0.00 0.00 39.78 34.28 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 -2.90 5.48 -0.32 6.41 -0.08 0.08 -4.87 116.55 120.35 3itv n ASP 369 Ca 0.01 -3.06 0.02 0.00 -1.51 0.00 0.00 54.79 50.25 3itv n ASP 369 Cb 0.55 -1.44 0.16 0.00 2.34 0.00 0.00 41.12 42.72 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 6.64 1.25 -0.12 -1.67 0.00 -1.90 -1.20 119.26 122.26 3itv h ALA 370 Ca 0.24 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 3itv h ALA 370 Cb 0.83 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3itv h ALA 370 CO 1.16 0.26 0.04 1.25 0.00 0.00 0.00 179.25 181.97 3itv h LEU 371 N 0.97 0.17 -0.92 0.00 6.46 -1.96 -1.40 115.31 118.63 3itv h LEU 371 Ca 0.40 -0.19 -0.10 0.00 -0.12 0.00 0.00 57.88 57.88 3itv h LEU 371 Cb 0.24 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.11 3itv h LEU 371 CO -0.20 0.31 -0.48 0.24 -0.62 0.00 0.00 178.44 177.70 3itv h MET 372 N 0.02 0.00 -0.05 1.25 2.86 -1.93 -1.08 114.93 116.00 3itv h MET 372 Ca 0.04 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 3itv h MET 372 Cb 0.20 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.86 3itv h MET 372 CO -0.00 0.48 0.01 0.00 1.06 0.00 0.00 176.91 178.45 3itv h ALA 373 N 1.52 0.07 -0.22 6.32 0.00 -1.04 0.52 119.26 126.43 3itv h ALA 373 Ca -0.00 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 3itv h ALA 373 Cb 0.94 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 3itv h ALA 373 CO 0.06 -0.30 -0.28 0.00 0.00 0.00 0.00 179.25 178.73 3itv h THR 374 N -0.15 1.27 0.00 0.00 1.03 -1.15 -2.20 112.91 111.71 3itv h THR 374 Ca 0.02 -1.31 -0.08 0.00 -0.01 0.00 0.00 66.41 65.03 3itv h THR 374 Cb 0.26 1.41 -0.01 0.00 -1.07 0.00 0.00 68.15 68.74 3itv h THR 374 CO 0.00 0.41 -0.37 -0.08 -0.01 0.00 0.00 175.52 175.47 3itv h GLU 375 N 0.38 0.00 -0.34 0.00 4.57 -1.01 -1.09 114.58 117.08 3itv h GLU 375 Ca 0.05 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.11 3itv h GLU 375 Cb 0.69 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 3itv h GLU 375 CO 0.05 0.37 -0.30 1.15 -1.18 0.00 0.00 179.01 179.11 3itv h THR 376 N 0.00 1.28 -0.30 0.32 2.02 -0.26 -0.01 112.91 115.96 3itv h THR 376 Ca -0.00 -1.43 -0.15 0.00 0.77 0.00 0.00 66.41 65.60 3itv h THR 376 Cb 0.72 1.33 -0.00 0.00 -1.74 0.00 0.00 68.15 68.47 3itv h THR 376 CO 0.05 0.47 -0.41 -0.07 0.37 0.00 0.00 175.52 175.93 3itv h LEU 377 N 0.62 0.88 -1.26 2.58 3.38 -1.20 -3.17 115.31 117.13 3itv h LEU 377 Ca 0.07 -0.50 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 3itv h LEU 377 Cb 0.81 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3itv h LEU 377 CO 0.07 1.21 -0.02 0.11 0.09 0.00 0.00 178.44 179.90 3itv h LYS 378 N 0.58 0.48 -0.32 1.13 1.79 -0.93 -1.17 116.57 118.12 3itv h LYS 378 Ca 0.03 -0.10 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 3itv h LYS 378 Cb 1.00 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.57 3itv h LYS 378 CO 0.10 0.52 0.11 0.00 -1.08 0.00 0.00 179.45 179.10 3itv h ARG 379 N 0.46 0.45 0.00 3.15 3.08 -0.97 0.28 114.38 120.83 3itv h ARG 379 Ca 0.10 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.09 3itv h ARG 379 Cb 0.33 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.29 3itv h ARG 379 CO 0.01 0.39 -0.00 0.00 -1.07 0.00 0.00 179.97 179.30 3itv h ALA 380 N 1.68 -0.00 -0.76 0.04 0.00 -1.47 -3.29 119.26 115.46 3itv h ALA 380 Ca 0.11 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3itv h ALA 380 Cb 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3itv h ALA 380 CO -0.01 -0.07 0.49 -0.92 0.00 0.00 0.00 179.25 178.73 3itv h TYR 381 N -0.86 0.97 0.00 0.00 3.20 -0.93 -2.06 116.97 117.29 3itv h TYR 381 Ca -0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3itv h TYR 381 Cb 0.84 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.79 3itv h TYR 381 CO 0.22 0.62 0.00 0.54 -1.64 0.00 0.00 178.16 177.90 3itv n ARG 382 N -4.41 0.16 -2.31 1.82 1.74 0.97 -4.76 116.66 109.87 3itv n ARG 382 Ca 0.08 0.36 -0.42 0.00 -0.77 0.00 0.00 57.85 57.10 3itv n ARG 382 Cb 0.04 -1.79 -0.03 0.00 -1.02 0.00 0.00 32.46 29.66 3itv n ARG 382 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3itv s THR 383 N -3.23 3.85 -0.74 0.55 2.01 -0.77 -4.95 115.64 112.36 3itv s THR 383 Ca 0.06 1.26 -0.27 0.00 0.31 0.00 0.00 61.69 63.05 3itv s THR 383 Cb 0.10 -3.81 0.03 0.00 0.01 0.00 0.00 72.50 68.83 3itv s THR 383 CO 0.40 0.03 1.26 -0.62 -0.69 0.00 0.00 174.62 175.00 3itv s ASP 384 N 1.50 6.16 -0.02 3.53 2.15 -1.26 -4.85 116.67 123.89 3itv s ASP 384 Ca 0.61 -0.50 0.11 0.00 0.43 0.00 0.00 52.55 53.21 3itv s ASP 384 Cb -0.30 -2.55 0.36 0.00 -0.30 0.00 0.00 42.92 40.12 3itv s ASP 384 CO 0.27 -1.81 1.27 1.33 -0.17 0.00 0.00 175.17 176.06 3itv n VAL 385 N 6.35 0.64 -0.33 1.11 0.24 -1.26 -4.40 118.33 120.67 3itv n VAL 385 Ca 0.03 -0.55 0.11 0.00 -2.04 0.00 0.00 64.34 61.88 3itv n VAL 385 Cb 0.49 0.18 0.31 0.00 -1.47 0.00 0.00 33.84 33.35 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 2.26 0.81 -0.42 7.34 4.57 -1.98 -0.27 114.58 126.90 3itv h GLU 386 Ca 0.00 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 3itv h GLU 386 Cb 0.62 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 3itv h GLU 386 CO 0.03 0.54 0.18 -1.35 -1.18 0.00 0.00 179.01 177.22 3itv h PRO 387 N 0.83 0.59 -0.34 0.92 0.11 -1.92 0.08 132.00 132.27 3itv h PRO 387 Ca 0.51 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 66.46 3itv h PRO 387 Cb 0.70 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.69 3itv h PRO 387 CO -0.28 0.48 -0.12 0.82 -0.21 0.00 0.00 178.00 178.68 3itv h ILE 388 N 0.59 1.28 -0.57 4.15 2.04 -1.39 -0.63 117.51 122.97 3itv h ILE 388 Ca 0.15 -1.21 -0.06 0.00 1.00 0.00 0.00 64.86 64.73 3itv h ILE 388 Cb 0.10 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 3itv h ILE 388 CO -0.02 0.40 0.12 -0.07 0.00 0.00 0.00 178.15 178.58 3itv h LEU 389 N 0.47 0.88 -0.54 1.44 3.38 -0.91 -0.88 115.31 119.15 3itv h LEU 389 Ca 0.08 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 3itv h LEU 389 Cb 0.64 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3itv h LEU 389 CO 0.04 0.90 0.07 0.00 0.09 0.00 0.00 178.44 179.54 3itv h ALA 390 N 1.02 0.72 -0.38 1.53 0.00 -0.90 -2.13 119.26 119.13 3itv h ALA 390 Ca 0.18 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 3itv h ALA 390 Cb 0.37 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3itv h ALA 390 CO 0.01 0.48 -0.22 1.49 0.00 0.00 0.00 179.25 181.01 3itv h GLU 391 N 0.80 0.75 -0.72 0.00 4.57 -0.98 -0.37 114.58 118.64 3itv h GLU 391 Ca 0.16 -0.30 -0.00 0.00 -1.18 0.00 0.00 59.36 58.04 3itv h GLU 391 Cb 0.44 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.96 3itv h GLU 391 CO 0.01 0.91 0.43 0.00 -1.18 0.00 0.00 179.01 179.18 3itv h ALA 392 N 1.09 0.91 -0.27 2.92 0.00 -0.96 -1.39 119.26 121.58 3itv h ALA 392 Ca 0.09 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3itv h ALA 392 Cb 0.72 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3itv h ALA 392 CO 0.06 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.69 3itv h ARG 393 N 0.98 0.47 -0.25 0.00 3.08 -1.08 -2.78 114.38 114.80 3itv h ARG 393 Ca 0.26 -0.15 0.05 0.00 0.07 0.00 0.00 59.98 60.21 3itv h ARG 393 Cb -0.03 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 29.93 3itv h ARG 393 CO -0.05 0.63 -0.09 -0.09 -1.07 0.00 0.00 179.97 179.31 3itv h ARG 394 N 0.25 -0.04 0.00 0.04 2.43 -0.63 0.44 114.38 116.87 3itv h ARG 394 Ca 0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 3itv h ARG 394 Cb 0.42 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 3itv h ARG 394 CO 0.01 -0.02 0.00 0.07 -1.51 0.00 0.00 179.97 178.52 3itv h ARG 395 N -0.04 0.00 -0.39 0.20 0.11 -1.26 -3.08 114.38 109.93 3itv h ARG 395 Ca 0.12 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.20 3itv h ARG 395 Cb 0.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.30 3itv h ARG 395 CO -0.27 0.00 0.00 0.25 0.10 0.00 0.00 179.97 180.05 3itv n THR 396 N -2.36 1.32 -0.45 0.08 -2.24 -0.86 -4.96 114.28 104.81 3itv n THR 396 Ca 0.02 -1.19 0.00 0.00 -2.27 0.00 0.00 64.05 60.61 3itv n THR 396 Cb 0.24 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 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 0.46 0.77 0.00 3.38 0.00 -1.01 -4.99 105.19 103.81 3itv n GLY 397 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.45 1.03 3.68 -0.02 0.00 0.15 -4.81 105.19 102.77 3itv n GLY 398 Ca 0.00 -1.99 -0.35 0.00 0.00 0.00 0.00 46.02 43.68 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 -2.59 3.35 0.22 4.61 0.00 -0.25 -4.33 121.76 122.77 3itv s ALA 399 Ca 0.00 -0.78 -0.08 0.00 0.00 0.00 0.00 51.96 51.10 3itv s ALA 399 Cb 0.00 -1.63 0.25 0.00 0.00 0.00 0.00 23.12 21.74 3itv s ALA 399 CO 0.00 0.48 1.84 0.28 0.00 0.00 0.00 175.76 178.35 3itv h VAL 400 N 4.38 1.04 -3.18 0.00 2.07 -1.88 -3.28 116.25 115.39 3itv h VAL 400 Ca -0.47 -0.29 -0.62 0.00 0.82 0.00 0.00 66.70 66.15 3itv h VAL 400 Cb 1.19 0.13 -0.40 0.00 -1.52 0.00 0.00 31.29 30.69 3itv h VAL 400 CO 0.59 0.15 -0.70 -0.62 0.02 0.00 0.00 177.57 177.01 3itv s ASP 401 N -5.70 3.97 0.14 0.57 -1.08 -1.26 -4.70 116.67 108.60 3itv s ASP 401 Ca -0.13 -2.64 -0.28 0.00 -0.52 0.00 0.00 52.55 48.98 3itv s ASP 401 Cb 0.16 -1.26 -0.04 0.00 -1.46 0.00 0.00 42.92 40.32 3itv s ASP 401 CO 0.77 -0.27 1.58 -0.65 0.52 0.00 0.00 175.17 177.12 3itv h PRO 402 N 6.82 -0.44 -0.78 4.34 0.11 -1.85 -1.29 132.00 138.92 3itv h PRO 402 Ca -0.05 0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.06 3itv h PRO 402 Cb 0.93 0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 3itv h PRO 402 CO 0.55 -0.29 0.35 0.28 -0.21 0.00 0.00 178.00 178.67 3itv h VAL 403 N -0.46 1.25 -0.79 3.15 2.07 -1.94 0.49 116.25 120.02 3itv h VAL 403 Ca 0.09 -0.75 -0.05 0.00 0.82 0.00 0.00 66.70 66.81 3itv h VAL 403 Cb 0.61 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 3itv h VAL 403 CO -0.42 0.31 0.31 0.00 0.02 0.00 0.00 177.57 177.79 3itv h ALA 404 N 1.18 1.03 -0.44 1.67 0.00 -1.95 -0.35 119.26 120.39 3itv h ALA 404 Ca 0.26 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 3itv h ALA 404 Cb 0.16 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3itv h ALA 404 CO -0.03 0.66 -0.26 1.15 0.00 0.00 0.00 179.25 180.77 3itv h THR 405 N 1.15 1.27 -0.33 0.00 2.02 -0.88 -1.15 112.91 114.99 3itv h THR 405 Ca 0.26 -1.42 0.00 0.00 0.77 0.00 0.00 66.41 66.02 3itv h THR 405 Cb 0.23 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 3itv h THR 405 CO -0.02 0.48 0.22 0.22 0.37 0.00 0.00 175.52 176.79 3itv h TYR 406 N 0.80 0.41 -0.62 3.16 3.20 -0.48 -1.35 116.97 122.10 3itv h TYR 406 Ca 0.10 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.90 3itv h TYR 406 Cb 0.83 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.94 3itv h TYR 406 CO 0.05 0.26 0.11 0.00 -1.64 0.00 0.00 178.16 176.94 3itv h ARG 407 N 0.45 1.00 0.00 1.82 3.08 -0.91 -2.55 114.38 117.26 3itv h ARG 407 Ca 0.12 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 3itv h ARG 407 Cb -0.05 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 3itv h ARG 407 CO -0.03 0.92 -0.20 0.00 -1.07 0.00 0.00 179.97 179.59 3itv h ALA 408 N 1.17 1.25 0.00 0.04 0.00 -0.79 -2.86 119.26 118.08 3itv h ALA 408 Ca 0.19 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3itv h ALA 408 Cb 0.40 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3itv h ALA 408 CO 0.01 0.24 -0.37 0.66 0.00 0.00 0.00 179.25 179.79 3itv h SER 409 N 0.00 0.00 -0.44 0.00 4.64 -0.82 -3.47 113.55 113.46 3itv h SER 409 Ca -0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.17 3itv h SER 409 Cb 0.49 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.53 3itv h SER 409 CO 0.03 0.37 -0.14 0.61 -0.87 0.00 0.00 176.83 176.83 3itv n GLY 410 N 0.53 0.79 0.14 -0.77 0.00 -1.08 -4.94 105.19 99.85 3itv n GLY 410 Ca 0.01 -0.71 -0.07 0.00 0.00 0.00 0.00 46.02 45.25 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 0.10 -0.61 1.61 3.20 -1.86 -2.12 116.97 117.30 3itv h TYR 411 Ca -0.15 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.79 3itv h TYR 411 Cb 0.57 -0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.79 3itv h TYR 411 CO 0.20 0.02 0.32 -0.09 -1.64 0.00 0.00 178.16 176.97 3itv h ARG 412 N 0.17 0.59 -0.62 1.82 9.65 -1.92 -1.12 114.38 122.95 3itv h ARG 412 Ca 0.14 -0.04 -0.06 0.00 -1.10 0.00 0.00 59.98 58.92 3itv h ARG 412 Cb 0.15 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.57 3itv h ARG 412 CO -0.18 0.39 0.13 0.00 2.80 0.00 0.00 179.97 183.11 3itv h ALA 413 N 1.32 1.06 0.46 2.80 0.00 -1.92 -0.83 119.26 122.16 3itv h ALA 413 Ca 0.27 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3itv h ALA 413 Cb 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3itv h ALA 413 CO -0.18 0.61 -0.30 -0.09 0.00 0.00 0.00 179.25 179.30 3itv h ARG 414 N 0.93 -0.71 0.00 0.00 2.43 -0.62 -2.66 114.38 113.75 3itv h ARG 414 Ca 0.19 0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.37 3itv h ARG 414 Cb 0.36 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 3itv h ARG 414 CO 0.00 -0.47 -0.18 -0.39 -1.51 0.00 0.00 179.97 177.42 3itv h VAL 415 N -0.73 0.56 -0.10 0.20 -1.51 -1.16 -2.46 116.25 111.06 3itv h VAL 415 Ca -0.05 -0.87 -0.05 0.00 -1.23 0.00 0.00 66.70 64.50 3itv h VAL 415 Cb 0.61 1.58 -0.01 0.00 -2.13 0.00 0.00 31.29 31.34 3itv h VAL 415 CO 0.04 0.18 -0.19 0.00 -1.23 0.00 0.00 177.57 176.37 3itv h ALA 416 N 1.82 1.51 0.00 5.19 0.00 -0.83 -0.67 119.26 126.28 3itv h ALA 416 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3itv h ALA 416 Cb 0.56 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3itv h ALA 416 CO 0.02 0.36 -0.44 0.00 0.00 0.00 0.00 179.25 179.19 3itv h ALA 417 N 1.66 0.75 0.00 0.00 0.00 -1.12 -3.34 119.26 117.21 3itv h ALA 417 Ca 0.03 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 3itv h ALA 417 Cb 0.43 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3itv h ALA 417 CO 0.03 0.00 -1.73 0.39 0.00 0.00 0.00 179.25 177.93 3itv n GLU 418 N -2.51 0.64 -4.10 0.00 1.02 -0.85 -4.92 120.64 109.92 3itv n GLU 418 Ca 0.03 0.05 -0.35 0.00 -0.02 0.00 0.00 57.16 56.87 3itv n GLU 418 Cb 0.48 -1.67 -0.12 0.00 -0.02 0.00 0.00 31.44 30.12 3itv n GLU 418 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3itv s ARG 419 N -3.04 3.74 0.13 3.49 0.52 -0.31 -5.09 118.95 118.38 3itv s ARG 419 Ca -0.06 -0.46 -0.30 0.00 -0.52 0.00 0.00 55.73 54.39 3itv s ARG 419 Cb 0.10 -3.11 -0.07 0.00 0.52 0.00 0.00 34.95 32.39 3itv s ARG 419 CO 0.84 0.12 1.09 -1.25 0.02 0.00 0.00 175.30 176.12 3itv s PRO 420 N 0.75 4.57 0.49 3.54 0.04 -1.26 -4.69 135.00 138.44 3itv s PRO 420 Ca 0.01 1.67 -0.19 0.00 0.04 0.00 0.00 61.00 62.53 3itv s PRO 420 Cb -0.14 -3.32 -0.08 0.00 0.04 0.00 0.00 34.50 31.00 3itv s PRO 420 CO 0.02 0.02 1.01 0.00 0.04 0.00 0.00 177.00 178.09 3itv s ALA 421 N 0.15 2.92 0.27 8.56 0.00 -1.26 -4.92 121.76 127.48 3itv s ALA 421 Ca 0.51 0.48 -0.30 0.00 0.00 0.00 0.00 51.96 52.65 3itv s ALA 421 Cb -0.28 -3.21 -0.10 0.00 0.00 0.00 0.00 23.12 19.53 3itv s ALA 421 CO 0.33 -0.25 1.48 -1.54 0.00 0.00 0.00 175.76 175.77 3itv s SER 422 N -2.25 6.57 0.00 0.00 1.04 -1.26 -4.91 113.70 112.88 3itv s SER 422 Ca 0.64 2.76 0.06 0.00 0.48 0.00 0.00 55.95 59.90 3itv s SER 422 Cb -0.14 -2.63 0.01 0.00 0.10 0.00 0.00 66.02 63.36 3itv s SER 422 CO 0.21 -0.76 0.54 1.33 0.98 0.00 0.00 173.24 175.54 3itv n VAL 423 N 2.13 0.00 -1.59 5.02 0.24 -1.26 -5.22 118.33 117.65 3itv n VAL 423 Ca 0.06 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 3itv n VAL 423 Cb 0.39 1.09 0.00 0.00 -1.47 0.00 0.00 33.84 33.85 3itv n VAL 423 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69