#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3itl h ARG 5 N 0.00 1.07 -5.26 -1.08 2.47 -1.93 -3.39 114.38 106.26 3itl h ARG 5 Ca 0.00 -0.06 -0.62 0.00 -1.26 0.00 0.00 59.98 58.03 3itl h ARG 5 Cb 0.00 -0.24 -0.18 0.00 -1.65 0.00 0.00 29.97 27.90 3itl h ARG 5 CO 0.00 0.71 -0.60 0.42 0.56 0.00 0.00 179.97 181.06 3itl s ILE 6 N -6.07 4.45 0.20 2.04 -1.09 -1.26 -5.03 121.20 114.44 3itl s ILE 6 Ca -0.13 -0.15 -0.32 0.00 -2.23 0.00 0.00 60.65 57.82 3itl s ILE 6 Cb 0.19 -2.99 -0.13 0.00 -1.58 0.00 0.00 42.46 37.94 3itl s ILE 6 CO 0.80 0.46 1.59 0.00 -1.23 0.00 0.00 174.94 176.57 3itl n ALA 7 N 3.63 1.88 -0.19 9.38 0.00 -1.26 -4.89 120.51 129.06 3itl n ALA 7 Ca -0.17 0.42 0.06 0.00 0.00 0.00 0.00 53.44 53.75 3itl n ALA 7 Cb 0.52 -2.40 0.35 0.00 0.00 0.00 0.00 19.45 17.92 3itl n ALA 7 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3itl h GLN 8 N 5.73 0.75 -0.09 0.00 4.20 -1.97 -1.93 115.11 121.80 3itl h GLN 8 Ca -0.45 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.17 3itl h GLN 8 Cb 1.24 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.84 3itl h GLN 8 CO 0.87 0.50 -0.18 0.38 -0.67 0.00 0.00 178.83 179.73 3itl h ASP 9 N 0.77 0.13 -0.17 1.46 2.03 -1.99 -0.28 116.42 118.38 3itl h ASP 9 Ca 0.32 -0.03 -0.14 0.00 -0.73 0.00 0.00 57.03 56.45 3itl h ASP 9 Cb 0.26 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.73 3itl h ASP 9 CO -0.11 0.33 -0.46 0.58 -1.03 0.00 0.00 179.24 178.56 3itl h VAL 10 N 0.13 1.33 -0.18 4.15 2.07 -1.73 -0.74 116.25 121.28 3itl h VAL 10 Ca 0.03 -1.71 -0.01 0.00 0.82 0.00 0.00 66.70 65.83 3itl h VAL 10 Cb 0.41 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 3itl h VAL 10 CO 0.03 0.53 0.09 0.58 0.02 0.00 0.00 177.57 178.81 3itl h VAL 11 N 0.27 1.12 -0.61 2.57 2.07 -1.20 -0.21 116.25 120.27 3itl h VAL 11 Ca -0.01 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 3itl h VAL 11 Cb 1.07 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 3itl h VAL 11 CO 0.10 0.12 0.36 0.00 0.02 0.00 0.00 177.57 178.16 3itl h ALA 12 N 0.96 0.78 -0.36 1.67 0.00 -1.06 -1.33 119.26 119.92 3itl h ALA 12 Ca 0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3itl h ALA 12 Cb 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3itl h ALA 12 CO -0.01 0.27 0.12 -0.09 0.00 0.00 0.00 179.25 179.54 3itl h ARG 13 N 0.83 0.57 0.00 0.00 2.43 -0.91 -1.24 114.38 116.06 3itl h ARG 13 Ca 0.22 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3itl h ARG 13 Cb -0.00 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 3itl h ARG 13 CO -0.04 0.58 0.00 0.93 -1.51 0.00 0.00 179.97 179.93 3itl h GLU 14 N 0.44 0.00 0.08 0.20 4.39 -0.89 -2.23 114.58 116.58 3itl h GLU 14 Ca 0.12 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.71 3itl h GLU 14 Cb 0.25 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3itl h GLU 14 CO -0.00 0.00 -0.50 -0.91 -1.16 0.00 0.00 179.01 176.44 3itl h ASN 15 N 0.00 0.27 -0.37 1.42 -0.26 -0.97 -3.27 115.58 112.40 3itl h ASN 15 Ca 0.00 -0.97 -0.01 0.00 -0.56 0.00 0.00 56.30 54.76 3itl h ASN 15 Cb 0.62 -0.09 -0.02 0.00 -1.06 0.00 0.00 38.32 37.77 3itl h ASN 15 CO 0.00 1.24 0.20 0.44 -1.06 0.00 0.00 177.43 178.25 3itl h ASP 16 N -0.63 0.50 0.16 5.81 3.32 -1.16 0.13 116.42 124.54 3itl h ASP 16 Ca -0.09 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 56.90 3itl h ASP 16 Cb 1.38 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.80 3itl h ASP 16 CO 0.08 0.43 -0.11 -0.09 -1.72 0.00 0.00 179.24 177.84 3itl h ARG 17 N 0.57 0.00 -0.08 3.56 2.43 -1.49 -2.91 114.38 116.46 3itl h ARG 17 Ca 0.14 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3itl h ARG 17 Cb 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3itl h ARG 17 CO -0.02 0.11 0.00 0.54 -1.51 0.00 0.00 179.97 179.09 3itl n ARG 18 N -4.11 0.93 -0.10 0.20 1.74 -0.59 -4.73 116.66 109.99 3itl n ARG 18 Ca -0.02 -1.23 -0.08 0.00 -0.77 0.00 0.00 57.85 55.74 3itl n ARG 18 Cb 0.19 -1.16 -0.01 0.00 -1.02 0.00 0.00 32.46 30.47 3itl n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3itl h ALA 19 N 1.46 0.43 0.09 7.54 0.00 -0.58 -2.36 119.26 125.84 3itl h ALA 19 Ca 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3itl h ALA 19 Cb 0.42 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3itl h ALA 19 CO 0.00 -0.12 -0.14 1.03 0.00 0.00 0.00 179.25 180.02 3itl h SER 20 N 0.44 -0.38 -0.94 0.00 0.87 -1.85 0.07 113.55 111.77 3itl h SER 20 Ca 0.13 0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.73 3itl h SER 20 Cb -0.03 0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 62.02 3itl h SER 20 CO -0.04 -0.21 0.58 0.00 -0.53 0.00 0.00 176.83 176.63 3itl h ALA 21 N 0.59 1.25 -0.53 6.23 0.00 -1.89 -1.97 119.26 122.94 3itl h ALA 21 Ca 0.02 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3itl h ALA 21 Cb 0.29 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3itl h ALA 21 CO -0.07 0.65 0.22 1.25 0.00 0.00 0.00 179.25 181.30 3itl h LEU 22 N 1.29 0.72 -0.42 0.00 5.85 -1.03 -0.09 115.31 121.63 3itl h LEU 22 Ca 0.34 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.94 3itl h LEU 22 Cb -0.07 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.73 3itl h LEU 22 CO -0.07 0.68 0.17 0.50 -0.34 0.00 0.00 178.44 179.38 3itl h LYS 23 N 0.71 0.33 -0.02 1.25 3.64 -0.52 0.30 116.57 122.26 3itl h LYS 23 Ca 0.18 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 3itl h LYS 23 Cb 0.18 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3itl h LYS 23 CO -0.02 0.22 0.01 0.93 -2.27 0.00 0.00 179.45 178.33 3itl h GLU 24 N 0.34 0.02 -0.53 1.90 4.39 -0.93 -1.52 114.58 118.26 3itl h GLU 24 Ca 0.19 -0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.79 3itl h GLU 24 Cb 0.15 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 3itl h GLU 24 CO -0.18 0.02 -0.08 -0.44 -1.16 0.00 0.00 179.01 177.17 3itl h ASP 25 N 0.02 0.96 -0.50 1.42 3.32 -0.61 -1.40 116.42 119.62 3itl h ASP 25 Ca 0.01 -0.30 -0.10 0.00 0.02 0.00 0.00 57.03 56.66 3itl h ASP 25 Cb 0.00 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 3itl h ASP 25 CO -0.00 1.06 -0.07 0.22 -1.72 0.00 0.00 179.24 178.73 3itl h TYR 26 N 0.87 1.03 -0.40 4.55 3.20 -0.34 -0.73 116.97 125.15 3itl h TYR 26 Ca 0.14 -0.20 -0.12 0.00 3.14 0.00 0.00 58.73 61.69 3itl h TYR 26 Cb 0.62 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 3itl h TYR 26 CO 0.04 0.98 -0.22 0.93 -1.64 0.00 0.00 178.16 178.25 3itl h GLU 27 N 0.78 0.86 -0.26 1.82 5.08 -1.21 0.55 114.58 122.20 3itl h GLU 27 Ca 0.13 -0.39 -0.00 0.00 -1.00 0.00 0.00 59.36 58.11 3itl h GLU 27 Cb 0.61 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3itl h GLU 27 CO 0.04 1.03 0.16 0.00 -1.00 0.00 0.00 179.01 179.24 3itl h ALA 28 N 0.81 0.33 -0.50 3.43 0.00 -1.14 -0.78 119.26 121.42 3itl h ALA 28 Ca 0.09 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3itl h ALA 28 Cb 0.78 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3itl h ALA 28 CO 0.06 -0.17 -0.02 1.25 0.00 0.00 0.00 179.25 180.37 3itl h LEU 29 N 0.34 0.83 -1.01 0.00 5.85 -1.04 -1.68 115.31 118.59 3itl h LEU 29 Ca 0.09 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 3itl h LEU 29 Cb -0.00 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.77 3itl h LEU 29 CO -0.02 0.90 0.49 1.23 -0.34 0.00 0.00 178.44 180.71 3itl h GLY 30 N 0.98 1.26 0.86 3.75 0.00 -0.41 0.17 103.07 109.69 3itl h GLY 30 Ca 0.15 -0.54 -0.08 0.00 0.00 0.00 0.00 47.33 46.85 3itl h GLY 30 CO 0.03 0.53 -0.18 0.00 0.00 0.00 0.00 176.54 176.91 3itl h ALA 31 N 1.35 0.33 -0.62 3.60 0.00 -0.84 -1.38 119.26 121.71 3itl h ALA 31 Ca 0.31 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3itl h ALA 31 Cb -0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3itl h ALA 31 CO -0.05 0.25 0.35 -0.97 0.00 0.00 0.00 179.25 178.83 3itl h ASN 32 N 0.23 0.76 -0.05 0.00 -0.73 -1.01 -1.59 115.58 113.20 3itl h ASN 32 Ca 0.04 -0.08 -0.08 0.00 1.87 0.00 0.00 56.30 58.05 3itl h ASN 32 Cb 0.72 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 39.10 3itl h ASN 32 CO 0.05 0.63 -0.21 -0.07 -0.37 0.00 0.00 177.43 177.46 3itl h LEU 33 N 0.84 0.43 -0.69 0.34 3.38 -0.93 -2.72 115.31 115.96 3itl h LEU 33 Ca 0.22 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 3itl h LEU 33 Cb 0.02 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3itl h LEU 33 CO -0.04 0.65 0.10 0.00 0.09 0.00 0.00 178.44 179.24 3itl h ALA 34 N 1.39 0.91 0.00 1.53 0.00 -0.68 0.29 119.26 122.70 3itl h ALA 34 Ca 0.07 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3itl h ALA 34 Cb 0.59 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3itl h ALA 34 CO 0.04 0.67 0.00 0.00 0.00 0.00 0.00 179.25 179.96 3itl h ARG 35 N 1.03 0.00 -0.54 0.00 3.08 -1.01 -0.66 114.38 116.29 3itl h ARG 35 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.25 3itl h ARG 35 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 3itl h ARG 35 CO 0.01 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.45 3itl n ARG 36 N -2.79 2.55 -1.40 0.04 1.74 -0.33 -4.94 116.66 111.53 3itl n ARG 36 Ca -0.00 -2.37 -0.06 0.00 -0.77 0.00 0.00 57.85 54.65 3itl n ARG 36 Cb 0.21 -1.53 -0.02 0.00 -1.02 0.00 0.00 32.46 30.10 3itl n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3itl n GLY 37 N 1.56 0.65 3.34 -0.13 0.00 -0.25 -5.03 105.19 105.32 3itl n GLY 37 Ca 0.21 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 3itl n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3itl s VAL 38 N -2.23 2.49 -0.48 1.61 1.01 0.87 -4.98 120.40 118.69 3itl s VAL 38 Ca 0.00 -0.91 -0.19 0.00 0.00 0.00 0.00 61.98 60.88 3itl s VAL 38 Cb 0.00 -1.95 0.04 0.00 0.00 0.00 0.00 36.38 34.47 3itl s VAL 38 CO 0.00 0.57 0.60 -0.62 0.00 0.00 0.00 175.10 175.65 3itl s ASP 39 N -0.22 6.24 0.45 3.32 2.15 -1.26 -2.97 116.67 124.37 3itl s ASP 39 Ca -0.01 -0.74 0.20 0.00 0.43 0.00 0.00 52.55 52.43 3itl s ASP 39 Cb -0.13 -2.29 1.16 0.00 -0.30 0.00 0.00 42.92 41.36 3itl s ASP 39 CO 0.03 -0.82 1.89 -0.29 -0.17 0.00 0.00 175.17 175.80 3itl h ILE 40 N 5.85 0.69 -0.48 4.11 2.10 -1.92 -1.21 117.51 126.64 3itl h ILE 40 Ca -0.27 -0.11 -0.05 0.00 1.08 0.00 0.00 64.86 65.51 3itl h ILE 40 Cb 1.10 0.35 -0.02 0.00 -1.09 0.00 0.00 36.82 37.16 3itl h ILE 40 CO 0.92 0.06 0.09 -0.33 -1.08 0.00 0.00 178.15 177.81 3itl h GLU 41 N 0.31 0.74 -0.40 2.19 4.39 -1.98 -0.56 114.58 119.28 3itl h GLU 41 Ca 0.42 -0.16 -0.09 0.00 0.34 0.00 0.00 59.36 59.88 3itl h GLU 41 Cb 1.16 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.69 3itl h GLU 41 CO -0.12 0.70 -0.11 0.00 -1.16 0.00 0.00 179.01 178.32 3itl h ALA 42 N 1.38 1.07 -0.05 3.43 0.00 -1.64 -0.98 119.26 122.47 3itl h ALA 42 Ca 0.16 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3itl h ALA 42 Cb 0.31 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3itl h ALA 42 CO 0.00 0.57 -0.08 0.28 0.00 0.00 0.00 179.25 180.02 3itl h VAL 43 N 0.64 1.41 -0.80 0.00 2.07 -1.36 -3.01 116.25 115.19 3itl h VAL 43 Ca 0.11 -1.33 0.03 0.00 0.82 0.00 0.00 66.70 66.33 3itl h VAL 43 Cb 0.55 2.17 -0.05 0.00 -1.52 0.00 0.00 31.29 32.45 3itl h VAL 43 CO 0.03 0.37 0.51 0.74 0.02 0.00 0.00 177.57 179.24 3itl h THR 44 N -0.33 1.13 -0.62 2.57 2.02 -1.00 -0.35 112.91 116.32 3itl h THR 44 Ca 0.00 -0.34 0.01 0.00 0.77 0.00 0.00 66.41 66.85 3itl h THR 44 Cb 0.63 0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 3itl h THR 44 CO 0.02 0.18 0.41 0.00 0.37 0.00 0.00 175.52 176.50 3itl h ALA 45 N 1.33 1.57 0.07 6.16 0.00 -1.20 -0.65 119.26 126.55 3itl h ALA 45 Ca 0.32 -0.04 -0.29 0.00 0.00 0.00 0.00 54.91 54.90 3itl h ALA 45 Cb 0.01 -0.25 0.03 0.00 0.00 0.00 0.00 17.79 17.58 3itl h ALA 45 CO -0.11 0.39 -1.17 0.87 0.00 0.00 0.00 179.25 179.23 3itl h LYS 46 N 0.82 0.66 -0.88 0.00 1.57 -1.24 -3.26 116.57 114.25 3itl h LYS 46 Ca 0.23 -0.81 -0.00 0.00 -1.87 0.00 0.00 60.65 58.20 3itl h LYS 46 Cb -0.08 0.25 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 3itl h LYS 46 CO -0.05 1.36 0.55 0.28 -0.57 0.00 0.00 179.45 181.02 3itl h VAL 47 N 0.33 1.24 -0.11 0.50 2.07 -0.70 -1.62 116.25 117.97 3itl h VAL 47 Ca -0.17 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 66.89 3itl h VAL 47 Cb 1.83 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.58 3itl h VAL 47 CO 0.23 0.24 0.15 -0.33 0.02 0.00 0.00 177.57 177.88 3itl h GLU 48 N 1.21 0.00 -0.35 1.57 5.08 -1.17 -1.85 114.58 119.07 3itl h GLU 48 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 3itl h GLU 48 Cb -0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.17 3itl h GLU 48 CO -0.06 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.58 3itl n LYS 49 N -3.62 2.31 -2.96 2.33 4.76 -0.63 -4.93 118.16 115.42 3itl n LYS 49 Ca -0.00 -2.03 -0.41 0.00 -2.87 0.00 0.00 58.31 52.99 3itl n LYS 49 Cb 0.25 -1.36 -0.05 0.00 -1.84 0.00 0.00 35.03 32.03 3itl n LYS 49 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 3itl s PHE 50 N -1.11 3.29 0.14 2.13 5.36 -0.70 -5.03 117.98 122.06 3itl s PHE 50 Ca 0.29 1.01 0.11 0.00 -0.96 0.00 0.00 56.93 57.38 3itl s PHE 50 Cb 0.16 -3.00 -0.04 0.00 -0.34 0.00 0.00 43.02 39.80 3itl s PHE 50 CO 0.22 -0.39 -0.26 -0.06 -1.46 0.00 0.00 175.22 173.26 3itl s PHE 51 N 2.75 2.29 -0.02 10.12 0.08 -1.26 -4.74 117.98 127.20 3itl s PHE 51 Ca 0.32 -0.38 0.00 0.00 0.12 0.00 0.00 56.93 57.00 3itl s PHE 51 Cb -0.15 -1.22 0.02 0.00 -0.57 0.00 0.00 43.02 41.09 3itl s PHE 51 CO 0.08 0.36 -0.00 0.54 -0.10 0.00 0.00 175.22 176.10 3itl s VAL 52 N -1.15 0.14 0.39 -0.44 0.11 -0.40 -4.69 120.40 114.36 3itl s VAL 52 Ca 0.15 0.05 -0.25 0.00 -2.93 0.00 0.00 61.98 59.00 3itl s VAL 52 Cb -0.10 -0.20 -0.09 0.00 -1.53 0.00 0.00 36.38 34.46 3itl s VAL 52 CO 0.06 0.11 1.10 0.00 -3.33 0.00 0.00 175.10 173.04 3itl s ALA 53 N 0.69 3.12 -0.13 1.54 0.00 0.44 -4.25 121.76 123.18 3itl s ALA 53 Ca -0.07 0.82 -0.05 0.00 0.00 0.00 0.00 51.96 52.66 3itl s ALA 53 Cb -0.10 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 3itl s ALA 53 CO -0.01 -0.34 0.06 0.08 0.00 0.00 0.00 175.76 175.54 3itl s VAL 54 N -1.53 4.78 0.02 0.00 1.01 -0.64 -0.79 120.40 123.26 3itl s VAL 54 Ca 0.57 -0.06 -0.30 0.00 0.00 0.00 0.00 61.98 62.19 3itl s VAL 54 Cb -0.26 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 3itl s VAL 54 CO 0.33 0.56 1.11 -2.16 0.00 0.00 0.00 175.10 174.94 3itl s PRO 55 N -0.46 4.47 0.31 2.72 0.04 -1.25 -1.20 135.00 139.63 3itl s PRO 55 Ca 0.10 1.62 0.03 0.00 0.04 0.00 0.00 61.00 62.79 3itl s PRO 55 Cb -0.12 -3.41 0.62 0.00 0.04 0.00 0.00 34.50 31.63 3itl s PRO 55 CO 0.02 -0.20 1.88 0.66 0.04 0.00 0.00 177.00 179.41 3itl h SER 56 N 6.86 0.84 0.72 6.66 4.64 -1.69 0.86 113.55 132.43 3itl h SER 56 Ca -0.40 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3itl h SER 56 Cb 1.21 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3itl h SER 56 CO 0.80 0.49 0.00 -2.67 -0.87 0.00 0.00 176.83 174.57 3itl n TRP 57 N -4.54 0.00 0.43 4.77 2.14 -1.26 -3.41 117.44 115.58 3itl n TRP 57 Ca 0.16 0.00 0.13 0.00 2.07 0.00 0.00 57.50 59.86 3itl n TRP 57 Cb 0.31 -0.48 0.42 0.00 -0.81 0.00 0.00 31.31 30.75 3itl n TRP 57 CO 0.00 0.00 0.00 0.78 2.07 0.00 0.00 177.69 180.54 3itl h GLY 58 N 3.77 0.00 0.73 -1.67 0.00 -1.11 -3.14 103.07 101.64 3itl h GLY 58 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3itl h GLY 58 CO 0.00 0.00 -0.11 3.33 0.00 0.00 0.00 176.54 179.76 3itl n VAL 59 N -2.56 0.00 -3.86 4.60 0.24 -1.22 -4.73 118.33 110.81 3itl n VAL 59 Ca 0.04 -0.08 -0.27 0.00 -2.04 0.00 0.00 64.34 61.99 3itl n VAL 59 Cb 0.39 -0.02 -0.03 0.00 -1.47 0.00 0.00 33.84 32.71 3itl n VAL 59 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3itl s GLY 60 N -2.41 1.76 0.20 7.63 0.00 -1.19 -4.67 107.32 108.64 3itl s GLY 60 Ca 0.30 -0.95 -0.30 0.00 0.00 0.00 0.00 44.72 43.77 3itl s GLY 60 CO 0.46 -0.93 1.32 -1.59 0.00 0.00 0.00 173.10 172.36 3itl s THR 61 N -1.77 3.17 0.62 0.90 2.01 -1.26 -4.62 115.64 114.69 3itl s THR 61 Ca 0.36 0.96 0.03 0.00 0.31 0.00 0.00 61.69 63.35 3itl s THR 61 Cb -0.11 -3.61 0.08 0.00 0.01 0.00 0.00 72.50 68.87 3itl s THR 61 CO 0.29 0.14 0.86 -0.83 -0.69 0.00 0.00 174.62 174.38 3itl s GLY 62 N 0.36 1.79 0.22 4.40 0.00 -0.11 -4.93 107.32 109.05 3itl s GLY 62 Ca 0.57 -1.71 -0.04 0.00 0.00 0.00 0.00 44.72 43.54 3itl s GLY 62 CO 0.38 -1.28 0.36 0.61 0.00 0.00 0.00 173.10 173.18 3itl n GLY 63 N -2.49 2.11 2.97 0.20 0.00 -1.26 -4.22 105.19 102.49 3itl n GLY 63 Ca 0.13 -1.39 -0.25 0.00 0.00 0.00 0.00 46.02 44.51 3itl n GLY 63 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3itl n THR 64 N -0.34 0.00 0.44 2.61 -2.24 -0.52 -5.00 114.28 109.23 3itl n THR 64 Ca -0.02 -1.88 0.11 0.00 -2.27 0.00 0.00 64.05 59.99 3itl n THR 64 Cb 0.36 0.24 0.45 0.00 -2.10 0.00 0.00 70.33 69.28 3itl n THR 64 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3itl n ARG 65 N -1.17 0.15 -0.01 -0.78 1.85 -1.26 -2.92 116.66 112.53 3itl n ARG 65 Ca -0.13 0.37 -0.11 0.00 -1.00 0.00 0.00 57.85 56.98 3itl n ARG 65 Cb 0.51 -1.78 -0.14 0.00 -1.05 0.00 0.00 32.46 30.00 3itl n ARG 65 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 3itl h PHE 66 N 0.00 0.11 -1.32 2.89 0.04 -2.06 -3.49 116.94 113.11 3itl h PHE 66 Ca 0.00 -0.08 0.30 0.00 2.80 0.00 0.00 57.97 60.99 3itl h PHE 66 Cb 0.36 -0.00 -0.18 0.00 2.20 0.00 0.00 35.95 38.33 3itl h PHE 66 CO 0.00 1.15 0.88 0.00 -0.60 0.00 0.00 178.31 179.74 3itl s ALA 67 N -2.60 -2.18 -0.06 2.45 0.00 -1.15 -5.14 121.76 113.09 3itl s ALA 67 Ca -0.07 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.36 3itl s ALA 67 Cb 0.08 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.14 3itl s ALA 67 CO 0.82 -0.70 -0.04 0.50 0.00 0.00 0.00 175.76 176.33 3itl s ARG 68 N -2.28 0.89 -0.74 0.00 3.52 -1.26 -1.44 118.95 117.63 3itl s ARG 68 Ca 0.11 -0.09 0.01 0.00 -0.13 0.00 0.00 55.73 55.64 3itl s ARG 68 Cb 0.01 -0.96 0.18 0.00 -1.56 0.00 0.00 34.95 32.62 3itl s ARG 68 CO -0.04 -0.14 0.56 -0.06 -0.81 0.00 0.00 175.30 174.82 3itl s PHE 69 N 1.18 3.62 0.57 5.12 0.08 -1.26 -5.06 117.98 122.23 3itl s PHE 69 Ca -0.07 -3.13 -0.21 0.00 0.12 0.00 0.00 56.93 53.64 3itl s PHE 69 Cb -0.14 -2.98 -0.05 0.00 -0.57 0.00 0.00 43.02 39.29 3itl s PHE 69 CO -0.01 -0.67 1.24 -0.35 -0.10 0.00 0.00 175.22 175.32 3itl n PRO 70 N 2.42 1.40 -0.42 0.24 -0.04 -1.26 -4.96 135.00 132.39 3itl n PRO 70 Ca 0.17 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 64.15 3itl n PRO 70 Cb 0.36 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 3itl n PRO 70 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3itl n GLY 71 N 0.93 1.18 3.88 0.55 0.00 -1.26 -5.09 105.19 105.38 3itl n GLY 71 Ca 0.12 -1.98 -0.30 0.00 0.00 0.00 0.00 46.02 43.86 3itl n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3itl s THR 72 N 0.92 4.79 -1.47 2.61 -4.23 -1.26 -4.20 115.64 112.80 3itl s THR 72 Ca 0.00 0.58 -0.11 0.00 -1.18 0.00 0.00 61.69 60.99 3itl s THR 72 Cb 0.00 -3.80 0.06 0.00 1.34 0.00 0.00 72.50 70.10 3itl s THR 72 CO 0.00 -0.76 0.97 0.61 -0.54 0.00 0.00 174.62 174.90 3itl n GLY 73 N -1.91 -0.47 3.71 3.99 0.00 -1.26 -4.79 105.19 104.46 3itl n GLY 73 Ca 0.03 0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 3itl n GLY 73 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3itl s GLU 74 N -6.45 4.20 0.12 1.61 0.41 -1.26 -4.71 118.70 112.62 3itl s GLU 74 Ca 0.54 2.40 -0.30 0.00 -0.41 0.00 0.00 54.97 57.19 3itl s GLU 74 Cb -0.26 -3.29 -0.07 0.00 -1.78 0.00 0.00 34.13 28.73 3itl s GLU 74 CO 0.81 -0.67 1.13 -1.25 -0.49 0.00 0.00 175.26 174.79 3itl s PRO 75 N 1.63 4.53 -0.14 0.39 0.04 -1.26 -4.95 135.00 135.24 3itl s PRO 75 Ca 0.72 1.72 -0.01 0.00 0.04 0.00 0.00 61.00 63.47 3itl s PRO 75 Cb -0.44 -3.31 0.03 0.00 0.04 0.00 0.00 34.50 30.82 3itl s PRO 75 CO 0.32 -0.05 -0.06 1.03 0.04 0.00 0.00 177.00 178.28 3itl s ARG 76 N 0.23 1.41 0.00 4.56 0.52 -1.26 -4.83 118.95 119.57 3itl s ARG 76 Ca 0.53 -0.36 0.00 0.00 -0.52 0.00 0.00 55.73 55.38 3itl s ARG 76 Cb -0.29 -1.77 0.00 0.00 0.52 0.00 0.00 34.95 33.41 3itl s ARG 76 CO 0.32 -0.36 0.00 0.41 0.02 0.00 0.00 175.30 175.70 3itl n GLY 77 N 4.93 2.43 0.23 -3.53 0.00 -1.26 -4.47 105.19 103.52 3itl n GLY 77 Ca -0.12 -1.81 0.06 0.00 0.00 0.00 0.00 46.02 44.15 3itl n GLY 77 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3itl h ILE 78 N 0.00 1.09 -0.32 -0.61 6.09 -1.90 -2.53 117.51 119.33 3itl h ILE 78 Ca 0.00 -0.56 -0.07 0.00 -1.37 0.00 0.00 64.86 62.86 3itl h ILE 78 Cb 0.00 1.30 -0.01 0.00 0.47 0.00 0.00 36.82 38.58 3itl h ILE 78 CO 0.00 0.16 -0.07 -0.26 -3.07 0.00 0.00 178.15 174.91 3itl h PHE 79 N 0.00 0.68 -0.77 2.19 0.04 -1.98 0.10 116.94 117.20 3itl h PHE 79 Ca -0.00 -0.14 -0.05 0.00 2.80 0.00 0.00 57.97 60.57 3itl h PHE 79 Cb 0.29 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 38.24 3itl h PHE 79 CO 0.00 0.78 0.27 -0.44 -0.60 0.00 0.00 178.31 178.32 3itl h ASP 80 N 0.38 1.09 -0.49 2.17 3.32 -1.74 -2.29 116.42 118.87 3itl h ASP 80 Ca 0.08 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 3itl h ASP 80 Cb 0.56 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 3itl h ASP 80 CO 0.03 0.99 0.19 0.11 -1.72 0.00 0.00 179.24 178.84 3itl h LYS 81 N 1.14 0.75 -0.64 3.56 1.57 -1.17 -2.37 116.57 119.41 3itl h LYS 81 Ca 0.25 -0.14 -0.05 0.00 -1.87 0.00 0.00 60.65 58.84 3itl h LYS 81 Cb 0.27 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 3itl h LYS 81 CO -0.01 0.68 0.22 -0.07 -0.57 0.00 0.00 179.45 179.69 3itl h LEU 82 N 0.66 0.89 -0.96 2.94 3.38 -0.63 -0.14 115.31 121.44 3itl h LEU 82 Ca 0.16 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.02 3itl h LEU 82 Cb 0.22 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 3itl h LEU 82 CO -0.01 0.82 0.63 0.44 0.09 0.00 0.00 178.44 180.41 3itl h ASP 83 N 0.94 1.07 0.22 -0.43 3.32 -1.08 -0.61 116.42 119.85 3itl h ASP 83 Ca 0.21 -0.02 -0.21 0.00 0.02 0.00 0.00 57.03 57.04 3itl h ASP 83 Cb 0.24 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3itl h ASP 83 CO -0.01 0.75 -0.84 0.44 -1.72 0.00 0.00 179.24 177.86 3itl h ASP 84 N 1.25 0.59 -0.25 6.45 3.32 -0.91 -3.07 116.42 123.80 3itl h ASP 84 Ca 0.37 -0.42 -0.03 0.00 0.02 0.00 0.00 57.03 56.97 3itl h ASP 84 Cb -0.06 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 3itl h ASP 84 CO -0.10 1.20 0.07 0.00 -1.72 0.00 0.00 179.24 178.68 3itl h ALA 86 N 1.59 1.76 -0.44 0.00 0.00 -1.03 -1.96 119.26 119.18 3itl h ALA 86 Ca 0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3itl h ALA 86 Cb 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3itl h ALA 86 CO -0.00 0.20 0.11 0.28 0.00 0.00 0.00 179.25 179.84 3itl h VAL 87 N 0.30 1.23 -0.57 0.00 2.07 -1.39 0.06 116.25 117.97 3itl h VAL 87 Ca 0.08 -0.80 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 3itl h VAL 87 Cb 0.05 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 3itl h VAL 87 CO -0.01 0.28 0.35 0.40 0.02 0.00 0.00 177.57 178.61 3itl h ILE 88 N 0.57 1.17 -0.33 4.57 2.04 -1.34 -1.72 117.51 122.47 3itl h ILE 88 Ca 0.14 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.56 3itl h ILE 88 Cb 0.31 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 3itl h ILE 88 CO 0.00 0.17 -0.11 -0.61 0.00 0.00 0.00 178.15 177.60 3itl h GLN 89 N 0.76 0.65 -0.68 2.37 5.75 -1.28 -0.67 115.11 122.01 3itl h GLN 89 Ca 0.20 -0.26 0.02 0.00 -0.15 0.00 0.00 58.65 58.46 3itl h GLN 89 Cb -0.03 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.46 3itl h GLN 89 CO -0.04 0.84 0.44 0.37 -2.65 0.00 0.00 178.83 177.79 3itl h GLN 90 N 0.42 0.86 0.07 1.69 4.15 -0.78 0.46 115.11 121.99 3itl h GLN 90 Ca 0.08 -0.05 -0.27 0.00 0.77 0.00 0.00 58.65 59.18 3itl h GLN 90 Cb 0.62 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.09 3itl h GLN 90 CO 0.04 0.57 -1.35 -0.07 -1.93 0.00 0.00 178.83 176.09 3itl h LEU 91 N 0.89 0.22 0.00 -2.39 3.38 -1.29 -3.36 115.31 112.75 3itl h LEU 91 Ca 0.26 -0.28 -0.28 0.00 0.09 0.00 0.00 57.88 57.67 3itl h LEU 91 Cb -0.05 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 3itl h LEU 91 CO -0.08 1.23 -2.26 0.35 0.09 0.00 0.00 178.44 177.77 3itl n THR 92 N -3.37 1.05 -1.53 0.22 -2.24 -0.26 -1.21 114.28 106.94 3itl n THR 92 Ca -0.10 -0.76 -0.18 0.00 -2.27 0.00 0.00 64.05 60.74 3itl n THR 92 Cb 1.01 -0.37 -0.08 0.00 -2.10 0.00 0.00 70.33 68.80 3itl n THR 92 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3itl n ARG 93 N -2.62 -1.50 -0.01 -0.78 5.12 0.16 -4.78 116.66 112.25 3itl n ARG 93 Ca -0.26 1.14 0.03 0.00 -1.93 0.00 0.00 57.85 56.83 3itl n ARG 93 Cb 1.01 -5.52 0.03 0.00 -1.16 0.00 0.00 32.46 26.82 3itl n ARG 93 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3itl n ALA 94 N 1.34 2.44 -3.10 7.54 0.00 -1.26 -4.77 120.51 122.70 3itl n ALA 94 Ca -0.18 -0.61 -0.22 0.00 0.00 0.00 0.00 53.44 52.43 3itl n ALA 94 Cb 0.65 -0.22 -0.04 0.00 0.00 0.00 0.00 19.45 19.84 3itl n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3itl n THR 95 N 0.34 1.15 0.31 0.00 -2.24 -1.26 -1.27 114.28 111.30 3itl n THR 95 Ca 0.04 -4.97 0.16 0.00 -2.27 0.00 0.00 64.05 57.01 3itl n THR 95 Cb 0.19 -0.83 0.69 0.00 -2.10 0.00 0.00 70.33 68.28 3itl n THR 95 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3itl h PRO 96 N 3.07 0.00 -6.75 -0.78 0.13 -1.86 -3.40 132.00 122.41 3itl h PRO 96 Ca 0.11 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.55 3itl h PRO 96 Cb 0.77 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 31.67 3itl h PRO 96 CO 0.63 0.00 -0.85 -0.80 -0.23 0.00 0.00 178.00 176.75 3itl s ASN 97 N -5.17 3.44 0.01 1.44 0.01 -1.26 -0.07 114.94 113.34 3itl s ASN 97 Ca 0.01 -0.60 0.06 0.00 -0.71 0.00 0.00 52.86 51.63 3itl s ASN 97 Cb 0.09 -0.37 -0.03 0.00 0.41 0.00 0.00 41.25 41.35 3itl s ASN 97 CO 0.47 0.23 -0.18 -0.69 -1.51 0.00 0.00 177.10 175.42 3itl s VAL 98 N -0.95 2.77 -0.20 1.60 1.01 -0.02 -1.61 120.40 123.00 3itl s VAL 98 Ca 0.14 -1.05 -0.09 0.00 0.00 0.00 0.00 61.98 60.98 3itl s VAL 98 Cb -0.10 -2.12 -0.05 0.00 0.00 0.00 0.00 36.38 34.11 3itl s VAL 98 CO 0.05 0.44 0.11 -0.44 0.00 0.00 0.00 175.10 175.25 3itl s SER 99 N -1.14 6.00 0.20 3.32 0.01 -0.34 -0.33 113.70 121.41 3itl s SER 99 Ca 0.13 0.17 0.00 0.00 1.31 0.00 0.00 55.95 57.56 3itl s SER 99 Cb -0.10 -2.05 -0.04 0.00 0.21 0.00 0.00 66.02 64.04 3itl s SER 99 CO 0.03 0.17 0.37 -0.76 0.41 0.00 0.00 173.24 173.47 3itl s LEU 100 N 0.41 4.25 -0.11 2.44 1.43 -1.25 -1.67 118.68 124.18 3itl s LEU 100 Ca 0.06 0.34 0.01 0.00 -1.03 0.00 0.00 54.13 53.51 3itl s LEU 100 Cb -0.12 -3.11 0.02 0.00 0.03 0.00 0.00 46.19 43.02 3itl s LEU 100 CO -0.01 -0.04 -0.14 -2.28 0.23 0.00 0.00 176.35 174.12 3itl s HIS 101 N -1.87 1.88 -0.08 0.29 2.46 -1.26 -1.29 115.29 115.42 3itl s HIS 101 Ca 0.37 -0.90 -0.02 0.00 0.47 0.00 0.00 55.06 54.99 3itl s HIS 101 Cb -0.11 -1.38 -0.03 0.00 -0.13 0.00 0.00 32.58 30.93 3itl s HIS 101 CO 0.29 -0.49 0.00 0.42 -2.47 0.00 0.00 174.74 172.50 3itl s ILE 102 N 1.12 4.29 -2.11 0.89 -1.09 -0.30 -0.09 121.20 123.91 3itl s ILE 102 Ca -0.04 -0.27 0.20 0.00 -2.23 0.00 0.00 60.65 58.30 3itl s ILE 102 Cb -0.14 -2.81 0.50 0.00 -1.58 0.00 0.00 42.46 38.43 3itl s ILE 102 CO -0.03 0.59 1.65 -0.81 -1.23 0.00 0.00 174.94 175.11 3itl n PRO 103 N 2.10 1.29 -0.25 2.79 -0.04 -1.26 -2.30 135.00 137.33 3itl n PRO 103 Ca -0.18 -0.43 0.03 0.00 -0.04 0.00 0.00 63.50 62.87 3itl n PRO 103 Cb 0.54 -1.33 0.16 0.00 -0.04 0.00 0.00 33.50 32.82 3itl n PRO 103 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3itl h TRP 104 N 0.88 0.56 -0.76 0.54 6.55 -1.88 -2.22 115.95 119.62 3itl h TRP 104 Ca 0.00 0.03 -0.31 0.00 0.95 0.00 0.00 58.89 59.56 3itl h TRP 104 Cb 0.19 -0.14 -0.19 0.00 -0.86 0.00 0.00 29.16 28.17 3itl h TRP 104 CO 0.04 0.14 0.40 -0.25 -1.05 0.00 0.00 178.44 177.72 3itl n ASP 105 N -4.94 4.15 -4.73 -3.49 8.00 0.88 -4.71 116.55 111.71 3itl n ASP 105 Ca 0.12 -3.23 -0.42 0.00 0.71 0.00 0.00 54.79 51.98 3itl n ASP 105 Cb 0.34 -0.76 -0.03 0.00 -0.02 0.00 0.00 41.12 40.66 3itl n ASP 105 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3itl s LYS 106 N -2.80 4.16 0.03 -1.24 2.20 -0.84 -4.90 119.74 116.36 3itl s LYS 106 Ca 0.50 2.52 -0.29 0.00 -0.36 0.00 0.00 55.97 58.34 3itl s LYS 106 Cb 0.41 -3.09 0.10 0.00 -1.51 0.00 0.00 37.83 33.74 3itl s LYS 106 CO 0.11 -0.68 1.15 0.00 -0.36 0.00 0.00 175.35 175.57 3itl s ALA 107 N 0.92 -2.00 0.00 3.13 0.00 -1.26 -4.93 121.76 117.62 3itl s ALA 107 Ca 0.71 0.57 -0.30 0.00 0.00 0.00 0.00 51.96 52.94 3itl s ALA 107 Cb -0.47 0.43 -0.07 0.00 0.00 0.00 0.00 23.12 23.00 3itl s ALA 107 CO 0.35 -1.00 1.78 0.34 0.00 0.00 0.00 175.76 177.23 3itl s ASP 108 N -2.89 6.57 0.23 0.00 2.15 -1.26 -4.88 116.67 116.59 3itl s ASP 108 Ca 0.13 2.46 -0.07 0.00 0.43 0.00 0.00 52.55 55.50 3itl s ASP 108 Cb 0.02 -2.54 0.41 0.00 -0.30 0.00 0.00 42.92 40.51 3itl s ASP 108 CO -0.02 -0.97 1.69 -0.65 -0.17 0.00 0.00 175.17 175.05 3itl h PRO 109 N 9.76 0.26 -0.91 4.34 0.11 -1.96 0.00 132.00 143.60 3itl h PRO 109 Ca -0.44 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.70 3itl h PRO 109 Cb 1.21 -0.06 -0.06 0.00 0.11 0.00 0.00 31.00 32.20 3itl h PRO 109 CO 0.95 0.17 0.60 0.87 -0.21 0.00 0.00 178.00 180.38 3itl h LYS 110 N 0.27 1.08 -0.30 1.05 1.57 -1.90 0.57 116.57 118.91 3itl h LYS 110 Ca 0.38 -0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.95 3itl h LYS 110 Cb 0.63 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 3itl h LYS 110 CO -0.48 0.71 -0.41 0.93 -0.57 0.00 0.00 179.45 179.64 3itl h GLU 111 N 1.11 0.74 -0.04 3.15 5.08 -1.44 -0.94 114.58 122.24 3itl h GLU 111 Ca 0.37 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3itl h GLU 111 Cb 0.08 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 3itl h GLU 111 CO -0.12 1.01 0.00 -0.07 -1.00 0.00 0.00 179.01 178.83 3itl h LEU 112 N 0.60 0.06 -0.83 1.33 3.38 -0.36 -0.69 115.31 118.80 3itl h LEU 112 Ca 0.05 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.78 3itl h LEU 112 Cb 0.96 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.64 3itl h LEU 112 CO 0.09 0.32 0.53 0.50 0.09 0.00 0.00 178.44 179.97 3itl h LYS 113 N -0.20 0.99 -0.55 1.13 1.63 -0.90 0.11 116.57 118.79 3itl h LYS 113 Ca 0.01 -0.06 -0.04 0.00 -0.85 0.00 0.00 60.65 59.72 3itl h LYS 113 Cb 0.29 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.67 3itl h LYS 113 CO 0.00 0.66 0.20 0.00 -3.45 0.00 0.00 179.45 176.86 3itl h ALA 114 N 1.36 0.71 -0.37 5.00 0.00 -1.00 -0.69 119.26 124.26 3itl h ALA 114 Ca 0.34 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.94 3itl h ALA 114 Cb 0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3itl h ALA 114 CO -0.12 0.34 -0.31 -0.09 0.00 0.00 0.00 179.25 179.06 3itl h ARG 115 N 0.75 0.81 0.06 0.00 9.65 -0.54 -1.65 114.38 123.46 3itl h ARG 115 Ca 0.18 -0.38 -0.00 0.00 -1.10 0.00 0.00 59.98 58.68 3itl h ARG 115 Cb 0.22 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 3itl h ARG 115 CO -0.01 1.01 -0.03 0.78 2.80 0.00 0.00 179.97 184.52 3itl h GLY 116 N 0.92 -0.08 1.05 2.80 0.00 -0.56 -1.55 103.07 105.65 3itl h GLY 116 Ca 0.07 0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.47 3itl h GLY 116 CO 0.08 -0.03 0.56 -0.55 0.00 0.00 0.00 176.54 176.59 3itl h ASP 117 N -0.14 0.91 0.26 0.19 3.32 -1.04 0.14 116.42 120.06 3itl h ASP 117 Ca -0.01 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.95 3itl h ASP 117 Cb 0.12 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3itl h ASP 117 CO 0.01 0.63 -0.34 0.00 -1.72 0.00 0.00 179.24 177.82 3itl h ALA 118 N 1.50 1.32 -0.00 3.45 0.00 -0.95 -2.92 119.26 121.65 3itl h ALA 118 Ca 0.34 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3itl h ALA 118 Cb 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3itl h ALA 118 CO -0.10 0.49 -0.50 1.28 0.00 0.00 0.00 179.25 180.42 3itl n LEU 119 N -4.11 0.96 -0.18 0.00 4.77 -0.61 -4.95 117.00 112.88 3itl n LEU 119 Ca -0.02 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 3itl n LEU 119 Cb 0.40 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 3itl n LEU 119 CO 0.40 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 3itl n GLY 120 N 1.44 0.63 3.24 -0.72 0.00 -0.37 -4.92 105.19 104.49 3itl n GLY 120 Ca 0.08 -0.78 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 3itl n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3itl s LEU 121 N -0.37 2.04 0.00 0.99 1.43 0.33 -4.89 118.68 118.21 3itl s LEU 121 Ca 0.00 -0.41 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 3itl s LEU 121 Cb 0.00 -1.15 0.04 0.00 0.03 0.00 0.00 46.19 45.11 3itl s LEU 121 CO 0.00 0.26 0.35 0.61 0.23 0.00 0.00 176.35 177.81 3itl n GLY 122 N 2.60 2.55 3.13 -3.19 0.00 0.90 -3.81 105.19 107.37 3itl n GLY 122 Ca -0.16 -2.23 -0.28 0.00 0.00 0.00 0.00 46.02 43.35 3itl n GLY 122 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3itl s PHE 123 N -1.62 2.02 0.00 1.61 0.08 -1.26 -0.85 117.98 117.96 3itl s PHE 123 Ca 0.27 -0.79 0.00 0.00 0.12 0.00 0.00 56.93 56.53 3itl s PHE 123 Cb -0.02 -1.39 0.00 0.00 -0.57 0.00 0.00 43.02 41.04 3itl s PHE 123 CO 0.17 -0.34 0.00 -3.47 -0.10 0.00 0.00 175.22 171.48 3itl n ASP 124 N 3.63 0.00 -4.68 1.36 2.03 0.55 -4.11 116.55 115.33 3itl n ASP 124 Ca -0.21 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.69 3itl n ASP 124 Cb 0.52 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.93 3itl n ASP 124 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3itl n ALA 125 N -3.00 0.99 -1.91 -1.67 0.00 -1.26 -4.56 120.51 109.09 3itl n ALA 125 Ca 0.00 0.27 -0.32 0.00 0.00 0.00 0.00 53.44 53.38 3itl n ALA 125 Cb 0.00 -2.22 -0.05 0.00 0.00 0.00 0.00 19.45 17.19 3itl n ALA 125 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3itl s MET 126 N -2.12 4.03 -0.13 0.00 -1.94 0.04 -3.80 119.30 115.38 3itl s MET 126 Ca 0.61 0.92 0.01 0.00 -1.71 0.00 0.00 55.69 55.51 3itl s MET 126 Cb -0.53 -2.22 0.02 0.00 2.01 0.00 0.00 34.83 34.11 3itl s MET 126 CO 0.58 -0.11 -0.13 -0.80 -0.01 0.00 0.00 175.02 174.55 3itl s ASN 127 N -2.68 2.49 0.51 3.03 0.01 -0.41 -0.43 114.94 117.46 3itl s ASN 127 Ca 0.58 -0.43 -0.06 0.00 -0.71 0.00 0.00 52.86 52.24 3itl s ASN 127 Cb -0.10 -1.07 -0.04 0.00 0.41 0.00 0.00 41.25 40.45 3itl s ASN 127 CO 0.23 -0.05 0.84 -0.94 -1.51 0.00 0.00 177.10 175.67 3itl s SER 128 N 1.40 6.24 -0.36 -1.22 1.04 -1.19 -1.15 113.70 118.46 3itl s SER 128 Ca 0.02 1.03 0.00 0.00 0.48 0.00 0.00 55.95 57.48 3itl s SER 128 Cb -0.13 -2.28 0.12 0.00 0.10 0.00 0.00 66.02 63.83 3itl s SER 128 CO -0.08 -0.65 0.17 0.21 0.98 0.00 0.00 173.24 173.87 3itl s ASN 129 N -4.13 3.68 -0.24 7.02 3.84 -0.97 -4.70 114.94 119.44 3itl s ASN 129 Ca 0.49 -2.08 0.11 0.00 0.21 0.00 0.00 52.86 51.60 3itl s ASN 129 Cb -0.10 -0.82 0.45 0.00 -0.55 0.00 0.00 41.25 40.22 3itl s ASN 129 CO 0.47 -0.34 1.19 0.35 -2.79 0.00 0.00 177.10 175.98 3itl n THR 130 N 4.25 2.13 -0.17 -5.21 -2.24 -1.26 -4.60 114.28 107.18 3itl n THR 130 Ca 0.04 -3.56 0.03 0.00 -2.27 0.00 0.00 64.05 58.29 3itl n THR 130 Cb 0.38 -0.46 0.06 0.00 -2.10 0.00 0.00 70.33 68.22 3itl n THR 130 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 3itl n PHE 131 N -0.76 0.15 -3.57 4.78 1.16 -1.26 -4.60 117.46 113.37 3itl n PHE 131 Ca 0.29 -0.56 -0.13 0.00 -1.87 0.00 0.00 57.45 55.19 3itl n PHE 131 Cb 0.87 -0.06 -0.05 0.00 -1.61 0.00 0.00 39.48 38.63 3itl n PHE 131 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 3itl s SER 132 N -1.20 -0.41 -0.16 5.98 1.04 -1.26 -4.93 113.70 112.76 3itl s SER 132 Ca 0.10 0.04 -0.10 0.00 0.48 0.00 0.00 55.95 56.47 3itl s SER 132 Cb 0.07 0.50 -0.05 0.00 0.10 0.00 0.00 66.02 66.64 3itl s SER 132 CO 0.05 -0.78 0.18 -1.81 0.98 0.00 0.00 173.24 171.86 3itl s ASP 133 N -2.26 6.33 0.17 7.02 1.01 -1.26 -4.84 116.67 122.84 3itl s ASP 133 Ca -0.03 0.39 -0.04 0.00 0.71 0.00 0.00 52.55 53.58 3itl s ASP 133 Cb -0.00 -2.11 -0.05 0.00 1.01 0.00 0.00 42.92 41.76 3itl s ASP 133 CO -0.05 0.23 0.40 0.00 0.21 0.00 0.00 175.17 175.95 3itl s ALA 134 N -0.04 3.77 0.42 5.23 0.00 -1.26 -5.05 121.76 124.84 3itl s ALA 134 Ca 0.12 -0.59 -0.26 0.00 0.00 0.00 0.00 51.96 51.24 3itl s ALA 134 Cb -0.12 -2.13 -0.10 0.00 0.00 0.00 0.00 23.12 20.77 3itl s ALA 134 CO 0.02 0.60 1.33 -2.30 0.00 0.00 0.00 175.76 175.41 3itl n PRO 135 N -0.11 2.10 -0.96 0.00 -0.02 -1.26 -2.20 135.00 132.54 3itl n PRO 135 Ca -0.02 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 3itl n PRO 135 Cb 0.52 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 3itl n PRO 135 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3itl n GLY 136 N 0.72 0.89 3.73 -1.23 0.00 -1.26 -4.99 105.19 103.05 3itl n GLY 136 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3itl n GLY 136 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3itl s GLN 137 N -0.08 4.16 0.17 1.61 0.74 -0.94 -4.92 119.66 120.40 3itl s GLN 137 Ca 0.00 2.51 -0.08 0.00 0.05 0.00 0.00 55.36 57.84 3itl s GLN 137 Cb 0.00 -3.08 0.05 0.00 1.10 0.00 0.00 33.01 31.08 3itl s GLN 137 CO 0.00 -0.66 1.55 0.00 -0.55 0.00 0.00 175.29 175.64 3itl h ALA 138 N 6.11 0.72 -3.60 1.58 0.00 -1.94 -3.44 119.26 118.69 3itl h ALA 138 Ca -0.44 -0.41 -0.54 0.00 0.00 0.00 0.00 54.91 53.52 3itl h ALA 138 Cb 1.21 -0.15 -0.32 0.00 0.00 0.00 0.00 17.79 18.52 3itl h ALA 138 CO 0.89 0.67 -0.83 -1.01 0.00 0.00 0.00 179.25 178.97 3itl s HIS 139 N -4.56 1.61 0.42 0.00 3.76 -1.26 -5.13 115.29 110.13 3itl s HIS 139 Ca -0.10 -0.55 -0.22 0.00 -0.15 0.00 0.00 55.06 54.03 3itl s HIS 139 Cb 0.12 -1.13 -0.10 0.00 1.11 0.00 0.00 32.58 32.58 3itl s HIS 139 CO 0.86 -0.24 0.99 0.45 -0.85 0.00 0.00 174.74 175.95 3itl s SER 140 N 0.38 6.83 -0.13 1.40 0.15 -1.26 -4.96 113.70 116.11 3itl s SER 140 Ca -0.10 1.84 0.17 0.00 0.70 0.00 0.00 55.95 58.56 3itl s SER 140 Cb -0.14 -2.56 0.72 0.00 -1.71 0.00 0.00 66.02 62.33 3itl s SER 140 CO 0.03 -0.43 1.62 -1.22 1.20 0.00 0.00 173.24 174.44 3itl n TYR 141 N -0.39 1.54 -0.25 3.44 4.01 -1.26 -4.57 117.16 119.68 3itl n TYR 141 Ca 0.06 -0.60 0.06 0.00 -0.16 0.00 0.00 57.90 57.26 3itl n TYR 141 Cb 0.52 -0.27 0.18 0.00 -0.31 0.00 0.00 39.34 39.46 3itl n TYR 141 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3itl h LYS 142 N 4.00 0.27 -0.52 -0.72 3.64 -1.95 -1.09 116.57 120.20 3itl h LYS 142 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3itl h LYS 142 Cb 1.49 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.25 3itl h LYS 142 CO 0.26 0.18 0.00 0.66 -2.27 0.00 0.00 179.45 178.28 3itl n TYR 143 N -5.15 1.80 0.00 1.91 4.01 -1.26 -5.05 117.16 113.42 3itl n TYR 143 Ca 0.14 -0.75 0.00 0.00 -0.16 0.00 0.00 57.90 57.13 3itl n TYR 143 Cb 0.46 -0.45 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 3itl n TYR 143 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3itl n GLY 144 N 0.43 1.35 0.00 2.72 0.00 -0.41 -4.66 105.19 104.61 3itl n GLY 144 Ca 0.26 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 44.12 3itl n GLY 144 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3itl n SER 145 N 0.00 0.00 0.29 1.61 3.41 -1.26 -4.24 113.62 113.43 3itl n SER 145 Ca 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.79 3itl n SER 145 Cb 0.00 0.00 0.87 0.00 -0.26 0.00 0.00 64.21 64.82 3itl n SER 145 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3itl h LEU 146 N 0.00 0.00 -2.98 1.04 3.38 -1.87 -2.50 115.31 112.38 3itl h LEU 146 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3itl h LEU 146 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3itl h LEU 146 CO 0.00 0.04 0.00 -1.54 0.09 0.00 0.00 178.44 177.03 3itl n SER 147 N -3.24 2.70 -4.71 -0.43 3.41 -1.26 -3.83 113.62 106.27 3itl n SER 147 Ca -0.01 -2.23 -0.38 0.00 -0.26 0.00 0.00 58.87 55.99 3itl n SER 147 Cb 0.21 -0.21 0.05 0.00 -0.26 0.00 0.00 64.21 64.00 3itl n SER 147 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3itl n HIS 148 N -0.12 1.86 0.24 7.33 -0.00 -0.94 -4.80 115.22 118.79 3itl n HIS 148 Ca 0.09 0.44 0.11 0.00 -0.00 0.00 0.00 57.72 58.37 3itl n HIS 148 Cb 0.45 -2.29 0.60 0.00 -0.00 0.00 0.00 29.99 28.75 3itl n HIS 148 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 3itl h THR 149 N 1.07 0.55 -3.28 3.57 1.35 -1.91 -3.43 112.91 110.84 3itl h THR 149 Ca -0.50 -0.82 -0.59 0.00 -0.55 0.00 0.00 66.41 63.95 3itl h THR 149 Cb 1.33 1.55 -0.08 0.00 -1.73 0.00 0.00 68.15 69.21 3itl h THR 149 CO 0.55 0.17 0.53 0.21 -0.25 0.00 0.00 175.52 176.72 3itl s ASN 150 N -6.15 6.85 0.24 5.36 2.47 -1.26 -4.96 114.94 117.48 3itl s ASN 150 Ca -0.01 1.04 -0.05 0.00 0.42 0.00 0.00 52.86 54.25 3itl s ASN 150 Cb 0.12 -2.45 0.37 0.00 -1.45 0.00 0.00 41.25 37.84 3itl s ASN 150 CO 0.61 -0.57 1.79 0.00 -3.72 0.00 0.00 177.10 175.21 3itl h ALA 151 N 7.72 1.08 -0.17 1.71 0.00 -1.99 -1.75 119.26 125.86 3itl h ALA 151 Ca -0.22 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 3itl h ALA 151 Cb 1.09 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3itl h ALA 151 CO 0.90 0.00 -0.06 0.00 0.00 0.00 0.00 179.25 180.09 3itl h ALA 152 N 1.45 1.59 -0.27 0.00 0.00 -1.96 -1.12 119.26 118.94 3itl h ALA 152 Ca 0.38 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.96 3itl h ALA 152 Cb 0.39 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3itl h ALA 152 CO -0.27 0.30 -0.48 1.15 0.00 0.00 0.00 179.25 179.96 3itl h THR 153 N 0.25 1.29 -0.56 0.00 2.02 -1.68 -1.53 112.91 112.69 3itl h THR 153 Ca 0.06 -1.67 -0.05 0.00 0.77 0.00 0.00 66.41 65.52 3itl h THR 153 Cb 0.27 1.67 -0.02 0.00 -1.74 0.00 0.00 68.15 68.33 3itl h THR 153 CO 0.01 0.54 0.15 0.03 0.37 0.00 0.00 175.52 176.63 3itl h ARG 154 N 0.57 0.88 -0.88 6.66 3.08 -1.01 -1.50 114.38 122.17 3itl h ARG 154 Ca 0.02 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 3itl h ARG 154 Cb 1.08 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.97 3itl h ARG 154 CO 0.11 0.81 0.50 0.00 -1.07 0.00 0.00 179.97 180.31 3itl h ALA 155 N 1.03 1.22 -0.62 0.04 0.00 -1.13 0.59 119.26 120.39 3itl h ALA 155 Ca 0.18 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3itl h ALA 155 Cb 0.31 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3itl h ALA 155 CO -0.00 0.64 0.16 0.37 0.00 0.00 0.00 179.25 180.42 3itl h GLN 156 N 1.23 0.99 -0.59 0.00 4.15 -0.93 -0.47 115.11 119.50 3itl h GLN 156 Ca 0.31 -0.24 -0.09 0.00 0.77 0.00 0.00 58.65 59.40 3itl h GLN 156 Cb 0.00 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.54 3itl h GLN 156 CO -0.05 0.90 0.01 0.00 -1.93 0.00 0.00 178.83 177.75 3itl h ALA 157 N 1.05 0.79 -0.17 3.38 0.00 -0.62 -1.46 119.26 122.23 3itl h ALA 157 Ca 0.20 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3itl h ALA 157 Cb 0.35 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3itl h ALA 157 CO 0.00 0.63 0.07 0.28 0.00 0.00 0.00 179.25 180.23 3itl h VAL 158 N 0.93 1.16 -0.86 0.00 2.07 -0.61 -2.25 116.25 116.69 3itl h VAL 158 Ca 0.17 -0.47 0.03 0.00 0.82 0.00 0.00 66.70 67.24 3itl h VAL 158 Cb 0.55 1.15 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 3itl h VAL 158 CO 0.03 0.15 0.57 -0.08 0.02 0.00 0.00 177.57 178.26 3itl h GLU 159 N 0.12 1.08 -0.48 1.57 4.57 -0.95 -0.90 114.58 119.58 3itl h GLU 159 Ca 0.06 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 3itl h GLU 159 Cb 0.17 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.50 3itl h GLU 159 CO -0.00 0.71 0.28 1.25 -1.18 0.00 0.00 179.01 180.07 3itl h HIS 160 N 1.11 0.64 -0.62 0.92 2.76 -0.99 -0.84 115.15 118.14 3itl h HIS 160 Ca 0.33 -0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.43 3itl h HIS 160 Cb -0.03 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 28.69 3itl h HIS 160 CO -0.00 0.46 0.12 -0.91 -1.30 0.00 0.00 177.93 176.30 3itl h ASN 161 N 0.64 0.93 -0.43 3.26 2.35 -0.79 -1.58 115.58 119.97 3itl h ASN 161 Ca 0.17 -0.20 -0.05 0.00 -0.55 0.00 0.00 56.30 55.67 3itl h ASN 161 Cb 0.01 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.11 3itl h ASN 161 CO -0.03 0.92 0.09 -0.07 -1.65 0.00 0.00 177.43 176.69 3itl h LEU 162 N 0.93 0.72 -0.96 1.61 3.38 -0.79 -1.67 115.31 118.53 3itl h LEU 162 Ca 0.19 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 3itl h LEU 162 Cb 0.38 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3itl h LEU 162 CO 0.01 0.73 0.01 -0.08 0.09 0.00 0.00 178.44 179.20 3itl h GLU 163 N 0.74 0.76 -0.38 1.13 4.81 -0.57 -1.72 114.58 119.36 3itl h GLU 163 Ca 0.16 -0.20 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 3itl h GLU 163 Cb 0.32 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 3itl h GLU 163 CO 0.00 0.77 0.07 0.00 -0.73 0.00 0.00 179.01 179.12 3itl h ILE 165 N 0.55 1.27 -0.58 0.00 2.04 -0.69 -0.82 117.51 119.28 3itl h ILE 165 Ca 0.13 -1.37 -0.02 0.00 1.00 0.00 0.00 64.86 64.59 3itl h ILE 165 Cb 0.24 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3itl h ILE 165 CO -0.00 0.47 0.27 -0.33 0.00 0.00 0.00 178.15 178.56 3itl h GLU 166 N 0.77 0.84 -0.47 2.37 4.39 -0.70 0.57 114.58 122.36 3itl h GLU 166 Ca 0.10 -0.13 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 3itl h GLU 166 Cb 0.79 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.27 3itl h GLU 166 CO 0.07 0.69 0.17 0.82 -1.16 0.00 0.00 179.01 179.60 3itl h ILE 167 N 0.79 1.21 -0.62 3.13 1.08 -1.19 -2.69 117.51 119.24 3itl h ILE 167 Ca 0.20 -0.68 0.00 0.00 -0.39 0.00 0.00 64.86 63.99 3itl h ILE 167 Cb 0.13 0.79 -0.03 0.00 -3.07 0.00 0.00 36.82 34.64 3itl h ILE 167 CO -0.02 0.25 0.40 1.23 -0.69 0.00 0.00 178.15 179.32 3itl h GLY 168 N 0.61 0.88 1.67 5.37 0.00 -0.67 -2.30 103.07 108.63 3itl h GLY 168 Ca 0.15 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 3itl h GLY 168 CO -0.01 0.34 0.19 0.50 0.00 0.00 0.00 176.54 177.56 3itl h LYS 169 N 0.84 0.44 0.00 4.80 1.57 -0.71 -1.01 116.57 122.51 3itl h LYS 169 Ca 0.23 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 3itl h LYS 169 Cb -0.07 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.14 3itl h LYS 169 CO -0.05 0.31 0.00 0.00 -0.57 0.00 0.00 179.45 179.15 3itl h ALA 170 N 1.77 1.00 -0.01 3.86 0.00 -1.09 -3.32 119.26 121.47 3itl h ALA 170 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3itl h ALA 170 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3itl h ALA 170 CO -0.02 0.00 -0.23 0.44 0.00 0.00 0.00 179.25 179.43 3itl n ILE 171 N -3.02 0.00 0.00 0.00 -5.35 -0.83 -4.81 119.36 105.35 3itl n ILE 171 Ca 0.03 -0.38 0.00 0.00 -0.27 0.00 0.00 62.75 62.13 3itl n ILE 171 Cb 0.44 1.11 0.00 0.00 -1.74 0.00 0.00 39.64 39.45 3itl n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3itl n GLY 172 N 0.93 0.86 3.79 3.28 0.00 -0.79 -4.61 105.19 108.65 3itl n GLY 172 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 3itl n GLY 172 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3itl s SER 173 N -1.79 5.31 -0.03 1.61 0.15 -0.45 -4.79 113.70 113.70 3itl s SER 173 Ca 0.00 1.86 0.07 0.00 0.70 0.00 0.00 55.95 58.57 3itl s SER 173 Cb 0.00 -2.53 0.11 0.00 -1.71 0.00 0.00 66.02 61.89 3itl s SER 173 CO 0.00 -1.49 1.05 0.29 1.20 0.00 0.00 173.24 174.29 3itl n LYS 174 N -2.53 0.32 -3.50 5.44 4.76 -1.26 -4.47 118.16 116.92 3itl n LYS 174 Ca 0.09 -1.49 -0.11 0.00 -2.87 0.00 0.00 58.31 53.93 3itl n LYS 174 Cb 0.53 -0.70 -0.03 0.00 -1.84 0.00 0.00 35.03 32.99 3itl n LYS 174 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3itl s ALA 175 N -0.70 -1.78 -0.10 7.82 0.00 -1.26 -2.03 121.76 123.70 3itl s ALA 175 Ca 0.11 1.03 0.01 0.00 0.00 0.00 0.00 51.96 53.11 3itl s ALA 175 Cb 0.10 0.28 0.02 0.00 0.00 0.00 0.00 23.12 23.52 3itl s ALA 175 CO -0.01 -0.60 -0.12 -1.17 0.00 0.00 0.00 175.76 173.86 3itl s LEU 176 N -2.13 1.56 -0.21 0.00 2.96 -0.66 -0.78 118.68 119.42 3itl s LEU 176 Ca 0.01 -0.36 -0.10 0.00 -0.22 0.00 0.00 54.13 53.45 3itl s LEU 176 Cb -0.01 -0.96 -0.05 0.00 0.50 0.00 0.00 46.19 45.67 3itl s LEU 176 CO -0.05 -0.02 0.14 -0.89 -1.32 0.00 0.00 176.35 174.20 3itl s THR 177 N 1.13 5.40 -0.31 3.68 2.01 0.43 -0.49 115.64 127.48 3itl s THR 177 Ca -0.05 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.15 3itl s THR 177 Cb -0.14 -3.48 0.07 0.00 0.01 0.00 0.00 72.50 68.95 3itl s THR 177 CO -0.03 0.42 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.63 3itl s VAL 178 N 0.51 2.66 -0.12 3.82 1.01 0.15 -3.15 120.40 125.29 3itl s VAL 178 Ca 0.08 -1.69 0.02 0.00 0.00 0.00 0.00 61.98 60.39 3itl s VAL 178 Cb -0.12 -2.64 0.01 0.00 0.00 0.00 0.00 36.38 33.63 3itl s VAL 178 CO -0.00 -0.23 -0.18 0.86 0.00 0.00 0.00 175.10 175.54 3itl s TRP 179 N 1.14 2.24 0.25 5.22 -0.00 -1.26 -2.14 118.94 124.39 3itl s TRP 179 Ca -0.02 -1.06 0.07 0.00 -0.00 0.00 0.00 56.10 55.09 3itl s TRP 179 Cb -0.20 -1.56 -0.05 0.00 -0.00 0.00 0.00 33.47 31.65 3itl s TRP 179 CO -0.04 -0.50 -0.08 0.96 -0.00 0.00 0.00 176.95 177.28 3itl s ILE 180 N 0.84 1.64 -1.42 5.86 -4.36 -1.26 -4.69 121.20 117.81 3itl s ILE 180 Ca -0.09 -2.15 0.25 0.00 -0.26 0.00 0.00 60.65 58.40 3itl s ILE 180 Cb -0.15 -2.31 0.06 0.00 1.25 0.00 0.00 42.46 41.31 3itl s ILE 180 CO -0.00 -0.40 1.35 0.61 0.24 0.00 0.00 174.94 176.74 3itl n GLY 181 N -0.51 -0.80 2.88 6.27 0.00 -1.26 -4.96 105.19 106.81 3itl n GLY 181 Ca -0.06 -0.45 -0.50 0.00 0.00 0.00 0.00 46.02 45.01 3itl n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3itl n ASP 182 N -0.99 0.42 0.00 1.61 9.92 -1.26 -4.12 116.55 122.14 3itl n ASP 182 Ca 0.08 0.94 0.00 0.00 -0.53 0.00 0.00 54.79 55.28 3itl n ASP 182 Cb 0.36 -0.72 0.00 0.00 -0.64 0.00 0.00 41.12 40.12 3itl n ASP 182 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3itl n GLY 183 N 2.08 -0.59 3.08 0.44 0.00 -1.26 -1.65 105.19 107.28 3itl n GLY 183 Ca 0.20 -0.67 -0.08 0.00 0.00 0.00 0.00 46.02 45.46 3itl n GLY 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3itl s SER 184 N -4.00 0.33 0.00 1.61 1.04 0.57 -4.90 113.70 108.35 3itl s SER 184 Ca 0.00 -0.74 0.14 0.00 0.48 0.00 0.00 55.95 55.83 3itl s SER 184 Cb 0.00 0.19 -0.08 0.00 0.10 0.00 0.00 66.02 66.23 3itl s SER 184 CO 0.00 -0.51 0.71 0.59 0.98 0.00 0.00 173.24 175.00 3itl n ASN 185 N 0.63 1.11 -3.93 7.02 4.13 -1.26 -1.34 115.26 121.62 3itl n ASN 185 Ca -0.18 -1.05 -0.14 0.00 1.68 0.00 0.00 54.58 54.89 3itl n ASN 185 Cb 0.59 0.73 -0.14 0.00 -1.54 0.00 0.00 39.78 39.43 3itl n ASN 185 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3itl s PHE 186 N -2.06 0.26 0.34 3.10 0.08 -1.26 -4.38 117.98 114.06 3itl s PHE 186 Ca 0.09 -0.09 -0.29 0.00 0.12 0.00 0.00 56.93 56.76 3itl s PHE 186 Cb 0.11 -0.17 -0.12 0.00 -0.57 0.00 0.00 43.02 42.28 3itl s PHE 186 CO 0.48 -0.02 1.49 -2.30 -0.10 0.00 0.00 175.22 174.78 3itl n PRO 187 N 2.87 2.59 0.00 0.24 -0.02 -1.26 -1.68 135.00 137.74 3itl n PRO 187 Ca -0.13 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 3itl n PRO 187 Cb 0.59 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 3itl n PRO 187 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3itl n GLY 188 N 1.12 2.94 0.29 -1.23 0.00 -1.26 -4.87 105.19 102.18 3itl n GLY 188 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.09 3itl n GLY 188 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3itl h GLN 189 N 0.75 0.66 -6.70 1.61 4.15 -1.76 -3.42 115.11 110.40 3itl h GLN 189 Ca 0.00 -0.04 -0.66 0.00 0.77 0.00 0.00 58.65 58.72 3itl h GLN 189 Cb 0.00 -0.15 -0.20 0.00 0.21 0.00 0.00 27.48 27.34 3itl h GLN 189 CO 0.00 0.44 -0.84 -1.12 -1.93 0.00 0.00 178.83 175.38 3itl s SER 190 N -5.53 3.32 -0.42 -0.69 0.01 -1.26 -5.09 113.70 104.03 3itl s SER 190 Ca -0.12 -0.81 -0.16 0.00 1.31 0.00 0.00 55.95 56.17 3itl s SER 190 Cb 0.19 -0.23 0.02 0.00 0.21 0.00 0.00 66.02 66.22 3itl s SER 190 CO 0.77 0.14 0.37 0.21 0.41 0.00 0.00 173.24 175.14 3itl s ASN 191 N -2.36 6.15 0.21 2.44 3.84 -1.26 -4.96 114.94 119.00 3itl s ASN 191 Ca 0.17 -0.84 -0.16 0.00 0.21 0.00 0.00 52.86 52.24 3itl s ASN 191 Cb -0.09 -2.19 0.22 0.00 -0.55 0.00 0.00 41.25 38.65 3itl s ASN 191 CO 0.08 -0.52 1.59 -0.26 -2.79 0.00 0.00 177.10 175.19 3itl h PHE 192 N 8.68 -0.73 -0.25 0.43 0.04 -1.98 -0.68 116.94 122.44 3itl h PHE 192 Ca -0.27 0.08 -0.05 0.00 2.80 0.00 0.00 57.97 60.52 3itl h PHE 192 Cb 1.12 0.43 -0.01 0.00 2.20 0.00 0.00 35.95 39.69 3itl h PHE 192 CO 0.59 -0.37 -0.05 1.15 -0.60 0.00 0.00 178.31 179.03 3itl h THR 193 N -0.07 1.28 -0.64 -1.55 2.02 -1.99 -2.49 112.91 109.47 3itl h THR 193 Ca 0.31 -1.05 -0.07 0.00 0.77 0.00 0.00 66.41 66.36 3itl h THR 193 Cb 0.56 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.40 3itl h THR 193 CO -0.77 0.33 0.10 0.03 0.37 0.00 0.00 175.52 175.58 3itl h ARG 194 N 0.24 1.04 -0.77 6.66 3.08 -1.89 -0.45 114.38 122.29 3itl h ARG 194 Ca 0.07 -0.27 -0.03 0.00 0.07 0.00 0.00 59.98 59.82 3itl h ARG 194 Cb 0.51 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.40 3itl h ARG 194 CO 0.02 0.95 0.38 0.00 -1.07 0.00 0.00 179.97 180.26 3itl h ALA 195 N 1.13 0.99 -0.22 0.04 0.00 -1.12 -1.10 119.26 118.97 3itl h ALA 195 Ca 0.20 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 3itl h ALA 195 Cb 0.42 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3itl h ALA 195 CO 0.01 0.55 -0.39 0.35 0.00 0.00 0.00 179.25 179.77 3itl h PHE 196 N 1.08 0.60 -0.56 0.00 3.57 -1.13 -1.45 116.94 119.06 3itl h PHE 196 Ca 0.27 -0.17 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 3itl h PHE 196 Cb 0.10 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 3itl h PHE 196 CO 0.01 0.83 0.22 0.93 -2.23 0.00 0.00 178.31 178.07 3itl h GLU 197 N 0.43 0.84 -0.62 1.11 5.08 -0.58 -0.16 114.58 120.68 3itl h GLU 197 Ca 0.04 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.20 3itl h GLU 197 Cb 0.87 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 3itl h GLU 197 CO 0.07 0.73 0.20 0.00 -1.00 0.00 0.00 179.01 179.01 3itl h ARG 198 N 0.77 0.96 -0.21 2.33 3.08 -1.00 -1.86 114.38 118.45 3itl h ARG 198 Ca 0.19 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 3itl h ARG 198 Cb 0.21 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 3itl h ARG 198 CO -0.01 0.85 0.13 -0.92 -1.07 0.00 0.00 179.97 178.94 3itl h TYR 199 N 0.89 0.28 -0.92 3.04 5.03 -0.92 -1.30 116.97 123.06 3itl h TYR 199 Ca 0.20 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.51 3itl h TYR 199 Cb 0.29 -0.09 -0.05 0.00 1.55 0.00 0.00 36.73 38.43 3itl h TYR 199 CO 0.02 0.21 0.59 -0.07 -1.32 0.00 0.00 178.16 177.59 3itl h LEU 200 N 0.26 1.07 -0.52 2.82 3.38 -0.85 0.47 115.31 121.95 3itl h LEU 200 Ca 0.08 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 3itl h LEU 200 Cb 0.01 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3itl h LEU 200 CO -0.01 0.80 -0.03 -1.28 0.09 0.00 0.00 178.44 178.00 3itl h SER 201 N 1.25 0.92 -0.47 -0.43 0.87 -1.10 -1.53 113.55 113.07 3itl h SER 201 Ca 0.33 -0.32 -0.11 0.00 -1.23 0.00 0.00 61.79 60.47 3itl h SER 201 Cb -0.11 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.59 3itl h SER 201 CO -0.07 1.02 -0.12 0.00 -0.53 0.00 0.00 176.83 177.14 3itl h ALA 202 N 0.93 0.65 0.00 6.23 0.00 -0.84 -2.79 119.26 123.45 3itl h ALA 202 Ca 0.14 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 3itl h ALA 202 Cb 0.57 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3itl h ALA 202 CO 0.03 0.56 -0.28 0.52 0.00 0.00 0.00 179.25 180.07 3itl h MET 203 N 0.76 0.00 -0.32 0.00 2.07 -0.80 -1.95 114.93 114.69 3itl h MET 203 Ca 0.12 0.00 -0.06 0.00 -2.07 0.00 0.00 59.70 57.69 3itl h MET 203 Cb 0.67 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.39 3itl h MET 203 CO 0.05 0.28 -0.07 0.00 1.07 0.00 0.00 176.91 178.24 3itl h ALA 204 N 1.72 1.29 -0.25 6.32 0.00 -1.01 0.03 119.26 127.35 3itl h ALA 204 Ca -0.00 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.52 3itl h ALA 204 Cb 0.53 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3itl h ALA 204 CO 0.04 0.48 -0.43 0.93 0.00 0.00 0.00 179.25 180.26 3itl h GLU 205 N 0.49 0.63 -0.36 0.00 5.08 -1.21 -2.49 114.58 116.71 3itl h GLU 205 Ca 0.10 -0.34 -0.15 0.00 -1.00 0.00 0.00 59.36 57.97 3itl h GLU 205 Cb 0.43 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 3itl h GLU 205 CO 0.02 0.94 -0.38 0.82 -1.00 0.00 0.00 179.01 179.41 3itl h ILE 206 N 0.51 1.28 -0.96 3.13 2.04 -1.12 -3.01 117.51 119.37 3itl h ILE 206 Ca 0.04 -1.55 0.05 0.00 1.00 0.00 0.00 64.86 64.40 3itl h ILE 206 Cb 0.96 1.40 -0.06 0.00 -0.74 0.00 0.00 36.82 38.38 3itl h ILE 206 CO 0.09 0.51 0.63 0.22 0.00 0.00 0.00 178.15 179.60 3itl h TYR 207 N 0.70 1.16 0.00 1.37 5.03 -0.83 -1.07 116.97 123.33 3itl h TYR 207 Ca 0.06 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.40 3itl h TYR 207 Cb 0.95 -0.38 -0.00 0.00 1.55 0.00 0.00 36.73 38.85 3itl h TYR 207 CO 0.06 0.63 -0.02 0.87 -1.32 0.00 0.00 178.16 178.38 3itl h LYS 208 N 1.16 0.00 -0.10 1.82 1.57 -1.30 -1.80 116.57 117.92 3itl h LYS 208 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 3itl h LYS 208 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 3itl h LYS 208 CO -0.14 0.02 0.00 0.41 -0.57 0.00 0.00 179.45 179.17 3itl n GLY 209 N -1.13 0.08 3.70 3.86 0.00 -0.41 -4.91 105.19 106.39 3itl n GLY 209 Ca -0.03 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 3itl n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3itl s LEU 210 N -1.73 4.32 1.06 0.99 1.43 -0.68 -5.02 118.68 119.06 3itl s LEU 210 Ca 0.34 1.63 -0.12 0.00 -1.03 0.00 0.00 54.13 54.96 3itl s LEU 210 Cb 0.18 -3.57 0.23 0.00 0.03 0.00 0.00 46.19 43.07 3itl s LEU 210 CO 0.29 -0.34 1.06 -2.84 0.23 0.00 0.00 176.35 174.75 3itl s PRO 211 N 1.40 -0.10 0.33 1.29 0.02 -1.26 -4.89 135.00 131.79 3itl s PRO 211 Ca 0.51 0.87 0.03 0.00 0.02 0.00 0.00 61.00 62.43 3itl s PRO 211 Cb -0.20 -1.65 0.64 0.00 0.02 0.00 0.00 34.50 33.30 3itl s PRO 211 CO 0.24 -3.18 1.92 -0.44 -0.33 0.00 0.00 177.00 175.21 3itl h ASP 212 N -2.23 0.80 -0.59 2.53 3.32 -2.00 -2.62 116.42 115.63 3itl h ASP 212 Ca -0.56 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.46 3itl h ASP 212 Cb 1.32 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.68 3itl h ASP 212 CO 0.51 0.50 0.05 -0.90 -1.72 0.00 0.00 179.24 177.68 3itl n ASP 213 N -4.50 5.39 -4.86 6.45 5.75 -1.26 -4.96 116.55 118.56 3itl n ASP 213 Ca 0.14 -2.95 -0.23 0.00 -0.01 0.00 0.00 54.79 51.74 3itl n ASP 213 Cb 0.25 -0.69 -0.04 0.00 -1.03 0.00 0.00 41.12 39.61 3itl n ASP 213 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3itl s TRP 214 N -2.73 3.22 0.12 2.11 0.52 -0.99 -4.90 118.94 116.29 3itl s TRP 214 Ca 0.52 -0.06 0.09 0.00 0.02 0.00 0.00 56.10 56.67 3itl s TRP 214 Cb 0.40 -1.48 -0.04 0.00 -1.15 0.00 0.00 33.47 31.21 3itl s TRP 214 CO 0.15 0.50 -0.21 0.15 0.02 0.00 0.00 176.95 177.56 3itl s LYS 215 N -3.67 1.19 -0.20 4.98 1.02 -0.86 -4.83 119.74 117.36 3itl s LYS 215 Ca 0.33 -1.24 0.01 0.00 0.02 0.00 0.00 55.97 55.09 3itl s LYS 215 Cb -0.09 -1.42 0.03 0.00 -0.52 0.00 0.00 37.83 35.83 3itl s LYS 215 CO 0.26 0.32 -0.16 -1.17 -0.92 0.00 0.00 175.35 173.68 3itl s LEU 216 N -2.12 2.54 -0.25 3.17 2.96 0.41 -1.66 118.68 123.73 3itl s LEU 216 Ca 0.09 -0.82 -0.07 0.00 -0.22 0.00 0.00 54.13 53.11 3itl s LEU 216 Cb -0.09 -1.52 -0.02 0.00 0.50 0.00 0.00 46.19 45.05 3itl s LEU 216 CO 0.05 -0.05 0.07 -0.36 -1.32 0.00 0.00 176.35 174.74 3itl s PHE 217 N 1.26 3.09 -0.08 5.38 0.08 0.35 -1.13 117.98 126.93 3itl s PHE 217 Ca 0.02 -0.50 -0.09 0.00 0.12 0.00 0.00 56.93 56.48 3itl s PHE 217 Cb -0.15 -2.24 -0.04 0.00 -0.57 0.00 0.00 43.02 40.02 3itl s PHE 217 CO -0.10 -0.39 0.21 -1.54 -0.10 0.00 0.00 175.22 173.30 3itl s SER 218 N 1.60 6.49 -0.16 1.36 1.04 -0.87 0.31 113.70 123.46 3itl s SER 218 Ca 0.06 0.58 0.01 0.00 0.48 0.00 0.00 55.95 57.08 3itl s SER 218 Cb -0.15 -2.11 0.01 0.00 0.10 0.00 0.00 66.02 63.87 3itl s SER 218 CO 0.03 0.38 -0.19 -0.70 0.98 0.00 0.00 173.24 173.74 3itl s GLU 219 N -1.12 3.08 0.44 4.02 2.12 -0.91 -0.98 118.70 125.36 3itl s GLU 219 Ca 0.18 -0.81 -0.10 0.00 0.36 0.00 0.00 54.97 54.61 3itl s GLU 219 Cb -0.13 -2.56 -0.06 0.00 0.26 0.00 0.00 34.13 31.64 3itl s GLU 219 CO 0.07 -0.08 0.80 -3.38 -0.54 0.00 0.00 175.26 172.13 3itl s HIS 220 N 1.01 3.50 -0.26 5.30 -3.43 -1.26 -4.72 115.29 115.45 3itl s HIS 220 Ca -0.02 1.03 -0.13 0.00 -0.80 0.00 0.00 55.06 55.14 3itl s HIS 220 Cb -0.15 -2.45 0.09 0.00 -1.43 0.00 0.00 32.58 28.65 3itl s HIS 220 CO -0.05 -0.20 0.62 0.21 -2.00 0.00 0.00 174.74 173.31 3itl s LYS 221 N -4.18 0.61 0.15 -0.38 2.20 -0.40 -4.75 119.74 112.99 3itl s LYS 221 Ca 0.51 1.19 -0.17 0.00 -0.36 0.00 0.00 55.97 57.14 3itl s LYS 221 Cb -0.10 0.27 0.01 0.00 -1.51 0.00 0.00 37.83 36.50 3itl s LYS 221 CO 0.36 -0.17 1.79 1.98 -0.36 0.00 0.00 175.35 178.95 3itl h MET 222 N 7.29 0.40 -3.01 4.03 1.85 -1.02 -3.35 114.93 121.11 3itl h MET 222 Ca -0.28 -0.02 0.06 0.00 -0.61 0.00 0.00 59.70 58.85 3itl h MET 222 Cb 1.19 -0.09 -0.05 0.00 0.43 0.00 0.00 31.60 33.08 3itl h MET 222 CO 0.17 0.26 0.22 1.52 -0.40 0.00 0.00 176.91 178.68 3itl s TYR 223 N -6.16 -0.17 0.02 1.39 1.13 -1.26 -4.47 117.35 107.83 3itl s TYR 223 Ca -0.13 -0.30 0.00 0.00 -1.41 0.00 0.00 57.07 55.23 3itl s TYR 223 Cb 0.10 0.70 0.00 0.00 -1.10 0.00 0.00 41.96 41.67 3itl s TYR 223 CO 0.71 -1.25 0.00 -1.91 -2.51 0.00 0.00 175.55 170.59 3itl n GLU 224 N -0.46 -0.82 0.10 -3.49 2.13 -1.26 -4.82 120.64 112.02 3itl n GLU 224 Ca -0.04 1.01 0.11 0.00 0.66 0.00 0.00 57.16 58.90 3itl n GLU 224 Cb 0.59 -0.84 0.45 0.00 0.27 0.00 0.00 31.44 31.91 3itl n GLU 224 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3itl n PRO 225 N 0.28 0.15 -3.03 5.31 -0.04 -1.26 -4.98 135.00 131.43 3itl n PRO 225 Ca 0.00 0.36 -0.40 0.00 -0.04 0.00 0.00 63.50 63.43 3itl n PRO 225 Cb 0.00 -1.78 -0.05 0.00 -0.04 0.00 0.00 33.50 31.63 3itl n PRO 225 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3itl s ALA 226 N -3.23 3.34 -1.06 0.55 0.00 -1.26 -4.97 121.76 115.13 3itl s ALA 226 Ca 0.05 0.17 0.14 0.00 0.00 0.00 0.00 51.96 52.33 3itl s ALA 226 Cb 0.10 -2.96 0.44 0.00 0.00 0.00 0.00 23.12 20.69 3itl s ALA 226 CO 0.38 -0.06 1.37 1.19 0.00 0.00 0.00 175.76 178.64 3itl n PHE 227 N 3.53 0.72 0.06 0.00 3.72 -1.23 -4.57 117.46 119.69 3itl n PHE 227 Ca -0.02 -0.55 0.00 0.00 -0.05 0.00 0.00 57.45 56.83 3itl n PHE 227 Cb 0.51 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 38.97 3itl n PHE 227 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 3itl n TYR 228 N 0.68 -0.59 -4.04 1.38 9.36 -0.49 -4.93 117.16 118.52 3itl n TYR 228 Ca 0.17 0.10 -0.09 0.00 3.32 0.00 0.00 57.90 61.39 3itl n TYR 228 Cb 0.56 0.17 -0.11 0.00 -0.63 0.00 0.00 39.34 39.33 3itl n TYR 228 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3itl s SER 229 N -5.55 0.52 -0.03 2.98 1.04 -0.45 -4.97 113.70 107.24 3itl s SER 229 Ca 0.00 -0.69 0.03 0.00 0.48 0.00 0.00 55.95 55.76 3itl s SER 229 Cb 0.00 0.11 0.01 0.00 0.10 0.00 0.00 66.02 66.24 3itl s SER 229 CO 0.00 -0.38 -0.10 -0.89 0.98 0.00 0.00 173.24 172.85 3itl s THR 230 N -2.31 0.87 0.10 2.02 2.01 -1.26 -0.31 115.64 116.76 3itl s THR 230 Ca -0.06 -0.39 -0.28 0.00 0.31 0.00 0.00 61.69 61.27 3itl s THR 230 Cb -0.04 -0.79 -0.11 0.00 0.01 0.00 0.00 72.50 71.58 3itl s THR 230 CO -0.03 0.28 1.64 0.58 -0.69 0.00 0.00 174.62 176.39 3itl h VAL 231 N 5.52 0.45 -3.45 3.82 2.07 -1.65 -3.03 116.25 119.98 3itl h VAL 231 Ca -0.33 0.00 -0.80 0.00 0.82 0.00 0.00 66.70 66.38 3itl h VAL 231 Cb 1.17 0.45 -0.28 0.00 -1.52 0.00 0.00 31.29 31.11 3itl h VAL 231 CO 0.48 0.00 0.51 0.52 0.02 0.00 0.00 177.57 179.11 3itl n VAL 232 N -5.38 4.71 0.05 2.57 0.31 -1.26 -4.84 118.33 114.49 3itl n VAL 232 Ca -0.08 -5.48 -0.13 0.00 -0.01 0.00 0.00 64.34 58.64 3itl n VAL 232 Cb 0.29 -2.50 -0.14 0.00 -0.91 0.00 0.00 33.84 30.58 3itl n VAL 232 CO 0.00 0.00 0.00 0.06 -1.32 0.00 0.00 176.83 175.57 3itl h GLN 233 N 6.44 0.14 0.00 5.55 -0.00 -1.67 -1.05 115.11 124.52 3itl h GLN 233 Ca 0.18 -0.24 -0.27 0.00 -0.00 0.00 0.00 58.65 58.32 3itl h GLN 233 Cb 0.83 0.09 -0.07 0.00 -0.00 0.00 0.00 27.48 28.33 3itl h GLN 233 CO 1.07 0.97 -0.18 -0.40 -0.00 0.00 0.00 178.83 180.29 3itl n ASP 234 N -3.35 -1.06 0.27 0.06 5.68 -1.26 -2.21 116.55 114.67 3itl n ASP 234 Ca -0.13 -2.68 0.15 0.00 -0.50 0.00 0.00 54.79 51.63 3itl n ASP 234 Cb 1.02 2.05 0.73 0.00 -1.14 0.00 0.00 41.12 43.77 3itl n ASP 234 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 3itl h TRP 235 N 1.88 0.00 -0.01 2.11 5.08 -1.95 -1.36 115.95 121.70 3itl h TRP 235 Ca -0.23 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.74 3itl h TRP 235 Cb 1.03 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.19 3itl h TRP 235 CO 0.00 0.10 -0.00 0.78 -1.28 0.00 0.00 178.44 178.04 3itl h GLY 236 N 1.28 0.03 1.07 11.11 0.00 -1.99 0.23 103.07 114.80 3itl h GLY 236 Ca -0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 3itl h GLY 236 CO 0.01 0.02 0.14 -0.84 0.00 0.00 0.00 176.54 175.87 3itl h THR 237 N -0.29 1.26 -0.69 4.70 2.02 -1.89 -2.22 112.91 115.81 3itl h THR 237 Ca 0.00 -1.01 0.02 0.00 0.77 0.00 0.00 66.41 66.19 3itl h THR 237 Cb 0.32 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 3itl h THR 237 CO 0.00 0.38 0.44 -1.13 0.37 0.00 0.00 175.52 175.59 3itl h ASN 238 N 1.05 0.75 -0.71 4.18 -0.73 -1.06 -0.94 115.58 118.13 3itl h ASN 238 Ca 0.21 -0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.36 3itl h ASN 238 Cb 0.41 -0.18 -0.03 0.00 0.27 0.00 0.00 38.32 38.79 3itl h ASN 238 CO 0.01 0.53 0.40 0.22 -0.37 0.00 0.00 177.43 178.22 3itl h TYR 239 N 0.89 0.97 -0.76 0.67 3.20 -0.25 -1.04 116.97 120.65 3itl h TYR 239 Ca 0.26 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.13 3itl h TYR 239 Cb -0.05 -0.31 -0.04 0.00 1.54 0.00 0.00 36.73 37.86 3itl h TYR 239 CO -0.03 0.68 0.51 -0.07 -1.64 0.00 0.00 178.16 177.60 3itl h LEU 240 N 0.98 0.86 0.39 2.82 3.38 -0.73 -0.28 115.31 122.72 3itl h LEU 240 Ca 0.25 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 3itl h LEU 240 Cb 0.02 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.56 3itl h LEU 240 CO -0.04 0.61 -0.19 0.40 0.09 0.00 0.00 178.44 179.32 3itl h ILE 241 N 1.01 0.59 -0.53 1.22 2.04 -0.36 -1.73 117.51 119.74 3itl h ILE 241 Ca 0.29 -0.42 0.01 0.00 1.00 0.00 0.00 64.86 65.73 3itl h ILE 241 Cb -0.08 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 3itl h ILE 241 CO -0.07 0.08 0.35 0.00 0.00 0.00 0.00 178.15 178.51 3itl h ALA 242 N -0.28 0.68 -0.55 1.87 0.00 -1.00 -0.56 119.26 119.42 3itl h ALA 242 Ca -0.05 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 3itl h ALA 242 Cb 0.52 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3itl h ALA 242 CO 0.09 0.10 0.08 0.37 0.00 0.00 0.00 179.25 179.89 3itl h GLN 243 N 0.71 0.87 -0.25 0.00 5.75 -1.10 -2.70 115.11 118.39 3itl h GLN 243 Ca 0.20 -0.20 -0.08 0.00 -0.15 0.00 0.00 58.65 58.41 3itl h GLN 243 Cb -0.07 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.36 3itl h GLN 243 CO -0.05 0.81 -0.17 1.15 -2.65 0.00 0.00 178.83 177.92 3itl h THR 244 N 0.82 1.31 -0.28 2.39 2.02 -0.89 -3.33 112.91 114.96 3itl h THR 244 Ca 0.17 -1.30 -0.05 0.00 0.77 0.00 0.00 66.41 66.01 3itl h THR 244 Cb 0.37 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 3itl h THR 244 CO 0.01 0.41 -0.01 -0.07 0.37 0.00 0.00 175.52 176.22 3itl h LEU 245 N 0.28 0.49 0.00 2.58 3.38 -1.01 -3.50 115.31 117.53 3itl h LEU 245 Ca 0.05 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3itl h LEU 245 Cb 0.71 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3itl h LEU 245 CO 0.05 0.69 0.00 0.61 0.09 0.00 0.00 178.44 179.88 3itl n GLY 246 N -0.29 1.39 0.42 0.83 0.00 -1.03 -4.92 105.19 101.60 3itl n GLY 246 Ca -0.03 -1.88 0.23 0.00 0.00 0.00 0.00 46.02 44.33 3itl n GLY 246 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3itl h PRO 247 N 0.00 0.26 -0.00 1.61 0.11 -1.91 -0.97 132.00 131.10 3itl h PRO 247 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 3itl h PRO 247 Cb 0.00 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.05 3itl h PRO 247 CO 0.00 0.17 -0.07 1.63 -0.21 0.00 0.00 178.00 179.52 3itl n LYS 248 N -4.45 0.44 -3.72 1.05 5.02 -1.26 -4.78 118.16 110.47 3itl n LYS 248 Ca 0.20 -0.09 -0.35 0.00 -2.02 0.00 0.00 58.31 56.05 3itl n LYS 248 Cb 0.82 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 34.24 3itl n LYS 248 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3itl s ALA 249 N -2.62 3.65 0.26 7.82 0.00 -0.37 -0.44 121.76 130.06 3itl s ALA 249 Ca 0.26 -0.76 0.02 0.00 0.00 0.00 0.00 51.96 51.48 3itl s ALA 249 Cb 0.20 -2.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.07 3itl s ALA 249 CO 0.49 0.04 0.16 -0.65 0.00 0.00 0.00 175.76 175.80 3itl s GLN 250 N 0.60 1.45 -0.12 0.00 -0.21 -0.28 -4.72 119.66 116.38 3itl s GLN 250 Ca 0.08 -1.80 -0.06 0.00 0.02 0.00 0.00 55.36 53.59 3itl s GLN 250 Cb -0.12 0.12 -0.04 0.00 1.00 0.00 0.00 33.01 33.97 3itl s GLN 250 CO 0.00 -0.45 0.11 0.00 -2.12 0.00 0.00 175.29 172.83 3itl s LEU 252 N -0.81 3.75 -0.31 0.00 0.20 -0.15 0.01 118.68 121.38 3itl s LEU 252 Ca 0.13 0.06 -0.08 0.00 0.69 0.00 0.00 54.13 54.94 3itl s LEU 252 Cb -0.12 -1.94 0.00 0.00 -0.43 0.00 0.00 46.19 43.71 3itl s LEU 252 CO 0.03 0.18 0.12 -0.69 -0.29 0.00 0.00 176.35 175.70 3itl s VAL 253 N 0.30 4.28 -0.30 1.68 1.01 -0.42 -3.98 120.40 122.96 3itl s VAL 253 Ca 0.03 -0.58 -0.10 0.00 0.00 0.00 0.00 61.98 61.33 3itl s VAL 253 Cb -0.12 -3.20 -0.02 0.00 0.00 0.00 0.00 36.38 33.03 3itl s VAL 253 CO 0.01 0.06 0.16 -0.62 0.00 0.00 0.00 175.10 174.71 3itl s ASP 254 N 1.55 5.66 0.34 3.32 -1.08 -1.26 -1.18 116.67 124.03 3itl s ASP 254 Ca 0.03 -0.35 0.14 0.00 -0.52 0.00 0.00 52.55 51.85 3itl s ASP 254 Cb -0.17 -2.04 1.02 0.00 -1.46 0.00 0.00 42.92 40.27 3itl s ASP 254 CO 0.04 -0.15 1.70 -0.07 0.52 0.00 0.00 175.17 177.22 3itl h LEU 255 N 8.36 0.57 -1.52 -1.34 3.38 -1.78 -1.37 115.31 121.60 3itl h LEU 255 Ca -0.34 0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.79 3itl h LEU 255 Cb 1.16 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.99 3itl h LEU 255 CO 0.60 -0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.73 3itl n GLY 256 N -1.33 1.03 1.91 0.83 0.00 -1.26 -4.22 105.19 102.14 3itl n GLY 256 Ca 0.29 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3itl n GLY 256 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3itl n HIS 257 N 0.48 2.23 -4.34 1.61 8.25 -0.52 -3.54 115.22 119.39 3itl n HIS 257 Ca 0.12 -1.00 -0.24 0.00 -0.26 0.00 0.00 57.72 56.34 3itl n HIS 257 Cb 0.40 -0.60 -0.09 0.00 1.12 0.00 0.00 29.99 30.82 3itl n HIS 257 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3itl s HIS 258 N -2.90 2.56 0.78 4.41 3.76 -1.26 -2.31 115.29 120.33 3itl s HIS 258 Ca 0.55 -0.25 -0.13 0.00 -0.15 0.00 0.00 55.06 55.07 3itl s HIS 258 Cb 0.43 -1.17 0.07 0.00 1.11 0.00 0.00 32.58 33.02 3itl s HIS 258 CO 0.14 0.61 1.18 0.00 -0.85 0.00 0.00 174.74 175.83 3itl s ALA 259 N -2.17 1.96 0.31 -1.40 0.00 -1.26 -4.90 121.76 114.30 3itl s ALA 259 Ca 0.29 0.77 -0.29 0.00 0.00 0.00 0.00 51.96 52.73 3itl s ALA 259 Cb -0.07 -3.45 -0.13 0.00 0.00 0.00 0.00 23.12 19.47 3itl s ALA 259 CO 0.17 -2.10 1.31 -2.30 0.00 0.00 0.00 175.76 172.84 3itl n PRO 260 N -3.17 2.08 -0.81 0.00 -0.02 -1.26 -2.13 135.00 129.69 3itl n PRO 260 Ca 0.13 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 3itl n PRO 260 Cb 0.51 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 3itl n PRO 260 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3itl n ASN 261 N 1.19 -0.48 -4.65 2.55 3.02 -1.26 -4.99 115.26 110.64 3itl n ASN 261 Ca 0.07 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.20 3itl n ASN 261 Cb 0.35 -1.17 0.00 0.00 -0.61 0.00 0.00 39.78 38.35 3itl n ASN 261 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3itl n THR 262 N -2.06 2.29 -2.99 3.41 -1.04 -0.91 -4.89 114.28 108.08 3itl n THR 262 Ca 0.00 -0.50 -0.44 0.00 -2.04 0.00 0.00 64.05 61.07 3itl n THR 262 Cb 0.02 -1.34 -0.03 0.00 -1.82 0.00 0.00 70.33 67.16 3itl n THR 262 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3itl s ASN 263 N -0.55 6.45 0.16 8.00 3.84 -1.26 -4.87 114.94 126.72 3itl s ASN 263 Ca 0.60 -1.77 -0.09 0.00 0.21 0.00 0.00 52.86 51.82 3itl s ASN 263 Cb -0.57 -2.36 0.03 0.00 -0.55 0.00 0.00 41.25 37.79 3itl s ASN 263 CO 0.59 -1.10 1.52 0.40 -2.79 0.00 0.00 177.10 175.72 3itl h ILE 264 N 5.77 1.27 0.00 -5.21 2.04 -1.98 -3.04 117.51 116.36 3itl h ILE 264 Ca -0.04 -1.51 -0.00 0.00 1.00 0.00 0.00 64.86 64.31 3itl h ILE 264 Cb 1.05 1.33 -0.00 0.00 -0.74 0.00 0.00 36.82 38.46 3itl h ILE 264 CO 1.08 0.50 -0.02 1.05 0.00 0.00 0.00 178.15 180.77 3itl h GLU 265 N 0.74 0.00 -0.28 2.37 9.09 -1.90 -0.94 114.58 123.66 3itl h GLU 265 Ca 0.07 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.32 3itl h GLU 265 Cb 0.91 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.01 3itl h GLU 265 CO 0.08 0.02 -0.48 1.98 0.05 0.00 0.00 179.01 180.67 3itl h MET 266 N 0.00 0.74 -0.74 1.06 4.05 -1.93 -1.56 114.93 116.56 3itl h MET 266 Ca -0.00 -0.43 -0.00 0.00 -0.28 0.00 0.00 59.70 58.99 3itl h MET 266 Cb 0.04 0.03 -0.04 0.00 -0.80 0.00 0.00 31.60 30.84 3itl h MET 266 CO 0.00 1.05 0.46 0.82 0.23 0.00 0.00 176.91 179.47 3itl h ILE 267 N 0.59 1.21 -0.34 1.77 2.04 -1.19 0.59 117.51 122.17 3itl h ILE 267 Ca 0.03 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.47 3itl h ILE 267 Cb 1.04 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 3itl h ILE 267 CO 0.10 0.21 0.19 0.58 0.00 0.00 0.00 178.15 179.24 3itl h VAL 268 N 1.01 1.03 -0.55 1.67 2.07 -1.06 -1.21 116.25 119.21 3itl h VAL 268 Ca 0.27 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.65 3itl h VAL 268 Cb -0.05 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3itl h VAL 268 CO -0.05 0.07 0.35 0.00 0.02 0.00 0.00 177.57 177.96 3itl h ALA 269 N 1.15 0.70 -0.32 1.67 0.00 -0.58 -1.80 119.26 120.09 3itl h ALA 269 Ca 0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3itl h ALA 269 Cb 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3itl h ALA 269 CO -0.06 0.17 0.18 0.00 0.00 0.00 0.00 179.25 179.54 3itl h ARG 270 N 0.75 0.45 -0.69 0.00 2.47 -0.56 -1.43 114.38 115.36 3itl h ARG 270 Ca 0.20 -0.05 -0.03 0.00 -1.26 0.00 0.00 59.98 58.84 3itl h ARG 270 Cb -0.04 -0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.16 3itl h ARG 270 CO -0.04 0.37 0.31 -0.07 0.56 0.00 0.00 179.97 181.10 3itl h LEU 271 N 0.40 0.91 -0.48 3.04 3.38 -1.04 -2.52 115.31 118.99 3itl h LEU 271 Ca 0.11 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3itl h LEU 271 Cb 0.05 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3itl h LEU 271 CO -0.02 0.78 0.03 0.40 0.09 0.00 0.00 178.44 179.72 3itl h ILE 272 N 0.99 1.26 -0.47 1.22 2.04 -1.05 0.20 117.51 121.69 3itl h ILE 272 Ca 0.24 -1.02 -0.00 0.00 1.00 0.00 0.00 64.86 65.08 3itl h ILE 272 Cb 0.14 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 3itl h ILE 272 CO -0.03 0.36 0.28 -0.61 0.00 0.00 0.00 178.15 178.16 3itl h GLN 273 N 0.70 0.63 -0.61 2.37 4.15 -0.93 -2.00 115.11 119.41 3itl h GLN 273 Ca 0.14 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.51 3itl h GLN 273 Cb 0.47 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.02 3itl h GLN 273 CO 0.02 0.44 0.00 1.19 -1.93 0.00 0.00 178.83 178.55 3itl n PHE 274 N -4.44 1.66 -2.52 3.99 3.72 -0.98 -4.96 117.46 113.93 3itl n PHE 274 Ca 0.04 -0.66 -0.21 0.00 -0.05 0.00 0.00 57.45 56.57 3itl n PHE 274 Cb 0.07 -0.33 -0.00 0.00 -0.94 0.00 0.00 39.48 38.28 3itl n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3itl n GLY 275 N 0.91 -0.50 0.16 1.37 0.00 -0.70 -4.91 105.19 101.52 3itl n GLY 275 Ca 0.26 0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.40 3itl n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3itl n LYS 276 N -3.20 1.25 -2.86 1.61 4.76 0.60 -4.93 118.16 115.39 3itl n LYS 276 Ca -0.22 -2.59 -0.43 0.00 -2.87 0.00 0.00 58.31 52.20 3itl n LYS 276 Cb 0.67 -1.45 -0.03 0.00 -1.84 0.00 0.00 35.03 32.38 3itl n LYS 276 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3itl s LEU 277 N -2.76 4.52 0.08 -0.35 2.96 -1.19 -0.31 118.68 121.62 3itl s LEU 277 Ca 0.31 -1.33 -0.14 0.00 -0.22 0.00 0.00 54.13 52.75 3itl s LEU 277 Cb 0.28 -2.42 -0.17 0.00 0.50 0.00 0.00 46.19 44.37 3itl s LEU 277 CO 0.02 -1.34 1.27 1.23 -1.32 0.00 0.00 176.35 176.20 3itl h GLY 278 N 11.18 0.78 0.00 7.98 0.00 -0.70 -3.39 103.07 118.92 3itl h GLY 278 Ca -0.13 -1.13 0.00 0.00 0.00 0.00 0.00 47.33 46.07 3itl h GLY 278 CO 1.18 1.00 0.00 0.61 0.00 0.00 0.00 176.54 179.33 3itl n GLY 279 N 0.75 -1.29 3.31 4.60 0.00 -1.15 -1.02 105.19 110.40 3itl n GLY 279 Ca -0.08 -0.98 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 3itl n GLY 279 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3itl s PHE 280 N -2.32 1.78 -0.29 1.61 0.08 0.41 -1.31 117.98 117.96 3itl s PHE 280 Ca 0.00 -0.46 0.03 0.00 0.12 0.00 0.00 56.93 56.62 3itl s PHE 280 Cb 0.00 -0.92 0.08 0.00 -0.57 0.00 0.00 43.02 41.61 3itl s PHE 280 CO 0.00 0.28 -0.03 -1.01 -0.10 0.00 0.00 175.22 174.36 3itl s HIS 281 N -1.79 3.14 0.14 0.36 3.76 -0.32 -1.64 115.29 118.94 3itl s HIS 281 Ca 0.12 -2.40 -0.21 0.00 -0.15 0.00 0.00 55.06 52.43 3itl s HIS 281 Cb -0.07 -2.18 -0.07 0.00 1.11 0.00 0.00 32.58 31.36 3itl s HIS 281 CO 0.06 -0.88 0.66 -0.06 -0.85 0.00 0.00 174.74 173.67 3itl s PHE 282 N 1.13 3.78 0.00 1.40 0.08 0.11 -2.35 117.98 122.13 3itl s PHE 282 Ca 0.00 1.39 0.00 0.00 0.12 0.00 0.00 56.93 58.44 3itl s PHE 282 Cb -0.19 -2.59 0.00 0.00 -0.57 0.00 0.00 43.02 39.67 3itl s PHE 282 CO -0.08 0.50 0.00 0.27 -0.10 0.00 0.00 175.22 175.81 3itl n ASN 283 N 1.37 0.00 -4.43 1.36 0.23 -1.26 -1.18 115.26 111.35 3itl n ASN 283 Ca -0.07 0.00 -0.21 0.00 -0.53 0.00 0.00 54.58 53.77 3itl n ASN 283 Cb 0.50 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.10 3itl n ASN 283 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3itl s ASP 284 N 0.00 2.47 0.16 0.53 -1.08 0.44 -4.61 116.67 114.58 3itl s ASP 284 Ca 0.00 -1.29 -0.24 0.00 -0.52 0.00 0.00 52.55 50.50 3itl s ASP 284 Cb 0.00 -0.11 0.06 0.00 -1.46 0.00 0.00 42.92 41.41 3itl s ASP 284 CO 0.00 -0.49 0.87 -0.94 0.52 0.00 0.00 175.17 175.12 3itl s SER 285 N -3.45 -0.25 0.00 -0.34 1.04 -1.26 -1.16 113.70 108.28 3itl s SER 285 Ca 0.33 -0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.39 3itl s SER 285 Cb 0.07 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.72 3itl s SER 285 CO 0.13 -0.97 0.00 1.17 0.98 0.00 0.00 173.24 174.55 3itl n LYS 286 N -0.43 1.25 0.02 4.02 4.81 -1.26 -4.75 118.16 121.83 3itl n LYS 286 Ca -0.07 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.36 3itl n LYS 286 Cb 0.61 -0.63 -0.01 0.00 0.02 0.00 0.00 35.03 35.03 3itl n LYS 286 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3itl n TYR 287 N -0.85 0.00 0.00 5.64 4.01 -1.26 -5.10 117.16 119.60 3itl n TYR 287 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3itl n TYR 287 Cb 0.12 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 3itl n TYR 287 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3itl n GLY 288 N 3.13 5.29 2.67 2.72 0.00 -1.26 -4.91 105.19 112.84 3itl n GLY 288 Ca -0.03 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.66 3itl n GLY 288 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3itl n ASP 289 N 0.00 5.85 0.28 1.61 4.64 -1.23 -4.72 116.55 122.98 3itl n ASP 289 Ca 0.00 -2.97 0.16 0.00 -1.38 0.00 0.00 54.79 50.60 3itl n ASP 289 Cb 0.00 -1.52 0.81 0.00 -1.04 0.00 0.00 41.12 39.37 3itl n ASP 289 CO 0.00 0.00 0.00 0.44 -0.82 0.00 0.00 177.20 176.82 3itl h ASP 290 N 5.49 0.00 -5.95 1.67 3.32 -1.84 -3.47 116.42 115.64 3itl h ASP 290 Ca 0.57 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 57.17 3itl h ASP 290 Cb 0.52 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 3itl h ASP 290 CO 1.69 0.07 -0.71 0.47 -1.72 0.00 0.00 179.24 179.05 3itl n ASP 291 N -3.39 -5.08 -4.92 6.45 8.00 -1.23 -4.77 116.55 111.61 3itl n ASP 291 Ca -0.01 -0.65 -0.27 0.00 0.71 0.00 0.00 54.79 54.57 3itl n ASP 291 Cb 0.23 -4.06 0.06 0.00 -0.02 0.00 0.00 41.12 37.33 3itl n ASP 291 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3itl s LEU 292 N -7.14 2.87 0.09 0.64 1.43 -0.31 -0.86 118.68 115.41 3itl s LEU 292 Ca 0.59 0.61 -0.33 0.00 -1.03 0.00 0.00 54.13 53.96 3itl s LEU 292 Cb -0.29 -3.29 -0.13 0.00 0.03 0.00 0.00 46.19 42.52 3itl s LEU 292 CO 0.73 -1.50 1.70 0.47 0.23 0.00 0.00 176.35 177.98 3itl n ASP 293 N -2.90 3.36 -4.57 2.29 9.92 -1.26 -0.42 116.55 122.96 3itl n ASP 293 Ca 0.07 1.04 -0.51 0.00 -0.53 0.00 0.00 54.79 54.86 3itl n ASP 293 Cb 0.60 -1.43 -0.05 0.00 -0.64 0.00 0.00 41.12 39.59 3itl n ASP 293 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3itl n ALA 294 N 4.62 -1.13 -0.83 2.24 0.00 -1.26 -1.43 120.51 122.72 3itl n ALA 294 Ca 0.19 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.13 3itl n ALA 294 Cb 0.30 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.73 3itl n ALA 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3itl n GLY 295 N 2.23 0.56 0.19 0.00 0.00 -1.26 -4.75 105.19 102.16 3itl n GLY 295 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 3itl n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3itl h ALA 296 N 0.00 1.00 0.00 4.61 0.00 -1.61 -3.30 119.26 119.96 3itl h ALA 296 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 3itl h ALA 296 Cb 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3itl h ALA 296 CO 0.00 0.00 -1.55 -0.89 0.00 0.00 0.00 179.25 176.81 3itl n ILE 297 N -2.74 0.54 -3.54 0.00 2.08 -1.26 -4.92 119.36 109.52 3itl n ILE 297 Ca 0.03 -0.14 -0.27 0.00 0.56 0.00 0.00 62.75 62.93 3itl n ILE 297 Cb 0.40 -1.62 -0.10 0.00 -0.75 0.00 0.00 39.64 37.56 3itl n ILE 297 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3itl n GLU 298 N -3.43 0.86 0.16 0.38 1.02 -1.26 -4.97 120.64 113.40 3itl n GLU 298 Ca -0.19 -3.66 0.05 0.00 -0.02 0.00 0.00 57.16 53.33 3itl n GLU 298 Cb 0.64 -1.85 0.50 0.00 -0.02 0.00 0.00 31.44 30.70 3itl n GLU 298 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3itl h PRO 299 N 5.35 0.18 -0.52 3.49 0.13 -1.92 -2.83 132.00 135.88 3itl h PRO 299 Ca 0.21 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 65.21 3itl h PRO 299 Cb 0.85 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.93 3itl h PRO 299 CO 0.51 0.21 -0.10 -0.92 -0.23 0.00 0.00 178.00 177.48 3itl h TYR 300 N 0.18 1.11 -0.94 1.56 3.20 -1.93 -1.68 116.97 118.46 3itl h TYR 300 Ca 0.04 -0.23 0.03 0.00 3.14 0.00 0.00 58.73 61.71 3itl h TYR 300 Cb 0.15 -0.27 -0.05 0.00 1.54 0.00 0.00 36.73 38.10 3itl h TYR 300 CO 0.00 1.04 0.62 -0.09 -1.64 0.00 0.00 178.16 178.08 3itl h ARG 301 N 0.86 1.19 -0.70 1.82 2.43 -1.93 0.26 114.38 118.31 3itl h ARG 301 Ca 0.14 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.19 3itl h ARG 301 Cb 0.66 -0.27 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 3itl h ARG 301 CO 0.05 0.79 0.26 1.25 -1.51 0.00 0.00 179.97 180.80 3itl h LEU 302 N 1.22 0.98 -0.57 3.80 5.85 -1.37 -0.93 115.31 124.30 3itl h LEU 302 Ca 0.36 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 3itl h LEU 302 Cb -0.06 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.69 3itl h LEU 302 CO -0.10 0.90 0.19 0.15 -0.34 0.00 0.00 178.44 179.24 3itl h PHE 303 N 1.01 0.91 -0.02 1.25 3.57 -0.32 -1.84 116.94 121.51 3itl h PHE 303 Ca 0.23 -0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 3itl h PHE 303 Cb 0.24 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 3itl h PHE 303 CO 0.02 0.75 -0.22 -0.07 -2.23 0.00 0.00 178.31 176.56 3itl h LEU 304 N 0.80 0.03 -0.13 0.59 3.38 -0.02 0.17 115.31 120.13 3itl h LEU 304 Ca 0.19 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 3itl h LEU 304 Cb 0.26 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 3itl h LEU 304 CO -0.01 0.25 -0.12 0.58 0.09 0.00 0.00 178.44 179.23 3itl h VAL 305 N 0.03 1.34 0.00 1.22 2.07 -0.81 -2.91 116.25 117.19 3itl h VAL 305 Ca 0.00 -1.25 -0.02 0.00 0.82 0.00 0.00 66.70 66.26 3itl h VAL 305 Cb 0.40 1.87 -0.00 0.00 -1.52 0.00 0.00 31.29 32.04 3itl h VAL 305 CO 0.03 0.36 -0.08 -0.26 0.02 0.00 0.00 177.57 177.64 3itl h PHE 306 N -0.06 0.00 -0.56 1.57 0.04 -0.70 -1.90 116.94 115.33 3itl h PHE 306 Ca 0.02 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.71 3itl h PHE 306 Cb 0.63 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.76 3itl h PHE 306 CO 0.08 0.08 0.03 -0.97 -0.60 0.00 0.00 178.31 176.93 3itl h ASN 307 N 0.00 0.91 0.10 2.17 -1.24 -0.48 0.87 115.58 117.91 3itl h ASN 307 Ca -0.00 -0.23 -0.15 0.00 0.71 0.00 0.00 56.30 56.64 3itl h ASN 307 Cb 0.40 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 39.20 3itl h ASN 307 CO 0.01 0.95 -0.52 -0.33 -1.29 0.00 0.00 177.43 176.25 3itl h GLU 308 N 0.88 0.47 -0.17 6.67 4.39 -1.26 -1.85 114.58 123.70 3itl h GLU 308 Ca 0.17 -0.28 -0.07 0.00 0.34 0.00 0.00 59.36 59.52 3itl h GLU 308 Cb 0.47 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.14 3itl h GLU 308 CO 0.02 0.87 -0.16 -0.07 -1.16 0.00 0.00 179.01 178.52 3itl h LEU 309 N 0.37 0.43 -0.85 1.33 3.38 -1.03 -2.88 115.31 116.06 3itl h LEU 309 Ca 0.01 -0.47 -0.11 0.00 0.09 0.00 0.00 57.88 57.41 3itl h LEU 309 Cb 1.03 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 3itl h LEU 309 CO 0.09 0.81 -0.27 0.58 0.09 0.00 0.00 178.44 179.75 3itl h VAL 310 N 0.06 1.27 -0.09 1.22 2.07 -0.85 0.61 116.25 120.55 3itl h VAL 310 Ca 0.03 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.22 3itl h VAL 310 Cb 0.69 1.36 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 3itl h VAL 310 CO 0.04 0.43 0.06 -0.78 0.02 0.00 0.00 177.57 177.34 3itl h ASP 311 N 0.47 0.10 0.04 0.57 1.82 -1.32 0.29 116.42 118.40 3itl h ASP 311 Ca 0.06 -0.00 -0.21 0.00 -0.39 0.00 0.00 57.03 56.50 3itl h ASP 311 Cb 0.72 -0.02 -0.02 0.00 0.68 0.00 0.00 39.33 40.69 3itl h ASP 311 CO 0.06 0.07 -1.09 0.00 -1.61 0.00 0.00 179.24 176.67 3itl h ALA 312 N 1.95 0.19 -0.50 -0.78 0.00 -1.10 -3.33 119.26 115.68 3itl h ALA 312 Ca 0.03 -1.03 0.13 0.00 0.00 0.00 0.00 54.91 54.04 3itl h ALA 312 Cb -0.00 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3itl h ALA 312 CO -0.01 0.63 0.36 1.49 0.00 0.00 0.00 179.25 181.72 3itl h GLU 313 N -0.73 0.07 -0.37 0.00 4.81 0.52 0.89 114.58 119.77 3itl h GLU 313 Ca -0.27 -0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 58.83 3itl h GLU 313 Cb 1.42 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.78 3itl h GLU 313 CO -0.07 0.04 -0.28 0.00 -0.73 0.00 0.00 179.01 177.97 3itl h ALA 314 N 1.75 0.80 0.00 2.92 0.00 -1.08 -3.19 119.26 120.46 3itl h ALA 314 Ca 0.24 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3itl h ALA 314 Cb 0.86 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3itl h ALA 314 CO -0.02 0.65 -1.21 0.54 0.00 0.00 0.00 179.25 179.21 3itl n ARG 315 N -4.09 0.23 -3.10 0.00 1.74 -0.27 -5.02 116.66 106.14 3itl n ARG 315 Ca -0.01 -0.05 -0.02 0.00 -0.77 0.00 0.00 57.85 57.01 3itl n ARG 315 Cb 0.47 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 3itl n ARG 315 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3itl n GLY 316 N 1.41 -1.24 3.77 -0.13 0.00 0.29 -4.94 105.19 104.35 3itl n GLY 316 Ca 0.02 0.49 -0.36 0.00 0.00 0.00 0.00 46.02 46.17 3itl n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3itl s VAL 317 N -2.99 2.98 0.16 1.61 1.01 -1.22 -4.94 120.40 117.01 3itl s VAL 317 Ca 0.01 0.68 -0.33 0.00 0.00 0.00 0.00 61.98 62.33 3itl s VAL 317 Cb -0.00 -3.31 -0.13 0.00 0.00 0.00 0.00 36.38 32.93 3itl s VAL 317 CO 0.76 -0.07 1.63 1.17 0.00 0.00 0.00 175.10 178.59 3itl n LYS 318 N -0.94 2.30 -1.08 2.72 4.81 -1.26 -1.48 118.16 123.23 3itl n LYS 318 Ca 0.10 0.83 -0.03 0.00 -0.87 0.00 0.00 58.31 58.34 3itl n LYS 318 Cb 0.49 -2.62 -0.01 0.00 0.02 0.00 0.00 35.03 32.91 3itl n LYS 318 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3itl n GLY 319 N 3.60 0.56 3.29 3.14 0.00 -1.26 -4.65 105.19 109.87 3itl n GLY 319 Ca 0.17 -0.26 -0.45 0.00 0.00 0.00 0.00 46.02 45.48 3itl n GLY 319 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3itl s PHE 320 N -1.88 3.51 -0.40 1.61 5.36 -0.55 -4.77 117.98 120.87 3itl s PHE 320 Ca 0.00 -1.78 0.10 0.00 -0.96 0.00 0.00 56.93 54.29 3itl s PHE 320 Cb 0.00 -3.73 0.37 0.00 -0.34 0.00 0.00 43.02 39.33 3itl s PHE 320 CO 0.00 -0.99 1.05 0.72 -1.46 0.00 0.00 175.22 174.54 3itl n HIS 321 N 4.51 -1.26 -1.68 10.12 8.25 -1.26 -4.75 115.22 129.14 3itl n HIS 321 Ca 0.01 -2.63 -0.42 0.00 -0.26 0.00 0.00 57.72 54.42 3itl n HIS 321 Cb 0.43 0.74 0.00 0.00 1.12 0.00 0.00 29.99 32.28 3itl n HIS 321 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3itl n PRO 322 N 0.03 1.89 -3.33 -0.41 -0.04 -1.26 -4.96 135.00 126.92 3itl n PRO 322 Ca 0.09 0.67 -0.38 0.00 -0.04 0.00 0.00 63.50 63.84 3itl n PRO 322 Cb 0.75 -2.27 -0.06 0.00 -0.04 0.00 0.00 33.50 31.88 3itl n PRO 322 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3itl s ALA 323 N -1.15 3.57 -0.13 0.55 0.00 -0.19 -4.91 121.76 119.50 3itl s ALA 323 Ca 0.59 -0.08 -0.01 0.00 0.00 0.00 0.00 51.96 52.45 3itl s ALA 323 Cb -0.55 -2.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 3itl s ALA 323 CO 0.60 0.29 -0.09 -1.01 0.00 0.00 0.00 175.76 175.54 3itl s HIS 324 N -0.54 2.89 -0.01 0.00 3.76 -1.26 -0.44 115.29 119.68 3itl s HIS 324 Ca 0.27 -0.46 -0.06 0.00 -0.15 0.00 0.00 55.06 54.66 3itl s HIS 324 Cb -0.18 -1.87 0.00 0.00 1.11 0.00 0.00 32.58 31.65 3itl s HIS 324 CO 0.15 -0.10 0.12 -1.64 -0.85 0.00 0.00 174.74 172.42 3itl s MET 325 N 0.24 0.36 -0.10 1.40 -1.94 -0.65 -0.42 119.30 118.19 3itl s MET 325 Ca -0.06 -0.23 -0.15 0.00 -1.71 0.00 0.00 55.69 53.54 3itl s MET 325 Cb -0.15 0.15 -0.05 0.00 2.01 0.00 0.00 34.83 36.80 3itl s MET 325 CO 0.04 -0.08 0.36 0.42 -0.01 0.00 0.00 175.02 175.76 3itl s ILE 326 N -0.91 5.21 -0.38 2.53 1.01 0.03 0.04 121.20 128.72 3itl s ILE 326 Ca -0.10 0.71 0.01 0.00 0.00 0.00 0.00 60.65 61.27 3itl s ILE 326 Cb -0.06 -3.69 0.14 0.00 0.01 0.00 0.00 42.46 38.86 3itl s ILE 326 CO 0.01 0.44 0.22 0.21 0.00 0.00 0.00 174.94 175.82 3itl s ASN 327 N -0.03 3.31 0.30 3.58 2.47 -0.33 -3.82 114.94 120.41 3itl s ASN 327 Ca 0.21 -2.33 0.03 0.00 0.42 0.00 0.00 52.86 51.19 3itl s ASN 327 Cb -0.14 -0.68 -0.05 0.00 -1.45 0.00 0.00 41.25 38.92 3itl s ASN 327 CO 0.08 -0.30 0.09 -1.10 -3.72 0.00 0.00 177.10 172.15 3itl s GLN 328 N 0.82 1.57 -0.09 0.43 -0.21 -1.26 -4.55 119.66 116.36 3itl s GLN 328 Ca 0.17 -1.87 0.00 0.00 0.02 0.00 0.00 55.36 53.68 3itl s GLN 328 Cb -0.23 -0.52 0.02 0.00 1.00 0.00 0.00 33.01 33.28 3itl s GLN 328 CO -0.01 -0.28 -0.08 0.45 -2.12 0.00 0.00 175.29 173.25 3itl s SER 329 N -3.41 1.96 -0.56 5.90 0.15 -0.04 -4.74 113.70 112.95 3itl s SER 329 Ca 0.36 -0.27 -0.10 0.00 0.70 0.00 0.00 55.95 56.64 3itl s SER 329 Cb 0.08 -0.78 0.14 0.00 -1.71 0.00 0.00 66.02 63.75 3itl s SER 329 CO 0.15 -0.09 0.45 -1.00 1.20 0.00 0.00 173.24 173.95 3itl s HIS 330 N 1.43 3.46 -0.15 3.44 0.09 -1.26 -4.61 115.29 117.69 3itl s HIS 330 Ca -0.01 -1.96 0.20 0.00 -0.00 0.00 0.00 55.06 53.30 3itl s HIS 330 Cb -0.13 -3.55 -0.14 0.00 -0.00 0.00 0.00 32.58 28.76 3itl s HIS 330 CO -0.05 -0.97 0.77 0.09 -0.00 0.00 0.00 174.74 174.58 3itl n ASN 331 N 4.57 0.61 -0.70 1.40 3.02 -1.26 -0.94 115.26 121.96 3itl n ASN 331 Ca -0.02 0.25 0.03 0.00 -0.03 0.00 0.00 54.58 54.81 3itl n ASN 331 Cb 0.41 0.71 0.04 0.00 -0.61 0.00 0.00 39.78 40.33 3itl n ASN 331 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3itl n VAL 332 N -2.67 0.43 -4.16 2.41 0.24 -1.26 -4.74 118.33 108.57 3itl n VAL 332 Ca -0.07 -0.82 -0.11 0.00 -2.04 0.00 0.00 64.34 61.30 3itl n VAL 332 Cb 0.71 0.47 -0.09 0.00 -1.47 0.00 0.00 33.84 33.45 3itl n VAL 332 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3itl s THR 333 N -0.65 0.01 -0.20 3.34 -4.23 -1.26 -5.10 115.64 107.55 3itl s THR 333 Ca 0.16 -1.89 -0.29 0.00 -1.18 0.00 0.00 61.69 58.49 3itl s THR 333 Cb 0.17 -2.42 -0.02 0.00 1.34 0.00 0.00 72.50 71.57 3itl s THR 333 CO -0.04 -0.03 1.41 -0.62 -0.54 0.00 0.00 174.62 174.79 3itl s ASP 334 N -3.13 6.70 0.30 3.99 -1.08 -1.26 -4.89 116.67 117.31 3itl s ASP 334 Ca 0.35 1.62 0.06 0.00 -0.52 0.00 0.00 52.55 54.06 3itl s ASP 334 Cb 0.06 -2.54 0.81 0.00 -1.46 0.00 0.00 42.92 39.79 3itl s ASP 334 CO 0.11 -0.98 1.71 -0.65 0.52 0.00 0.00 175.17 175.87 3itl h PRO 335 N 9.25 0.45 -0.57 4.34 0.11 -1.87 -1.02 132.00 142.69 3itl h PRO 335 Ca -0.30 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.72 3itl h PRO 335 Cb 1.12 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 3itl h PRO 335 CO 0.99 0.30 0.09 0.82 -0.21 0.00 0.00 178.00 179.99 3itl h ILE 336 N 0.47 1.26 -0.53 4.15 2.04 -1.86 -1.40 117.51 121.63 3itl h ILE 336 Ca 0.60 -0.98 -0.08 0.00 1.00 0.00 0.00 64.86 65.41 3itl h ILE 336 Cb 1.15 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 3itl h ILE 336 CO -0.51 0.36 0.03 -0.33 0.00 0.00 0.00 178.15 177.70 3itl h GLU 337 N 0.84 0.91 -0.57 2.37 5.08 -1.61 -0.78 114.58 120.82 3itl h GLU 337 Ca 0.17 -0.27 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 3itl h GLU 337 Cb 0.42 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 3itl h GLU 337 CO 0.01 0.92 0.12 0.77 -1.00 0.00 0.00 179.01 179.83 3itl h SER 338 N 0.79 0.88 -0.36 1.42 0.02 -1.22 -1.11 113.55 113.97 3itl h SER 338 Ca 0.15 -0.24 -0.08 0.00 -0.84 0.00 0.00 61.79 60.78 3itl h SER 338 Cb 0.48 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 3itl h SER 338 CO 0.02 0.90 -0.03 -0.07 -1.14 0.00 0.00 176.83 176.51 3itl h LEU 339 N 0.82 0.72 0.37 5.07 3.38 -1.11 0.13 115.31 124.69 3itl h LEU 339 Ca 0.18 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3itl h LEU 339 Cb 0.37 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3itl h LEU 339 CO 0.01 0.81 -0.18 0.40 0.09 0.00 0.00 178.44 179.57 3itl h ILE 340 N 0.70 0.64 0.00 1.22 2.04 -0.78 -1.27 117.51 120.07 3itl h ILE 340 Ca 0.13 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 3itl h ILE 340 Cb 0.47 0.72 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 3itl h ILE 340 CO 0.02 0.03 -0.14 0.78 0.00 0.00 0.00 178.15 178.84 3itl h ASN 341 N -0.58 0.00 -0.06 1.72 2.35 -1.04 -1.80 115.58 116.18 3itl h ASN 341 Ca -0.05 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.55 3itl h ASN 341 Cb 0.43 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.81 3itl h ASN 341 CO 0.08 0.14 -0.53 0.28 -1.65 0.00 0.00 177.43 175.76 3itl h SER 342 N 0.00 0.56 -0.62 5.81 0.02 -0.58 -1.36 113.55 117.39 3itl h SER 342 Ca -0.00 -0.69 -0.02 0.00 -0.84 0.00 0.00 61.79 60.24 3itl h SER 342 Cb 0.58 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 3itl h SER 342 CO 0.02 1.17 0.32 0.00 -1.14 0.00 0.00 176.83 177.20 3itl h ALA 343 N 0.41 1.36 -0.36 3.77 0.00 -1.02 -1.42 119.26 121.99 3itl h ALA 343 Ca -0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3itl h ALA 343 Cb 1.20 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3itl h ALA 343 CO 0.11 0.51 0.19 -0.91 0.00 0.00 0.00 179.25 179.14 3itl h ASN 344 N 0.90 0.45 -0.23 0.00 -0.26 -1.20 -1.72 115.58 113.53 3itl h ASN 344 Ca 0.23 -0.10 -0.04 0.00 -0.56 0.00 0.00 56.30 55.82 3itl h ASN 344 Cb 0.07 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 37.20 3itl h ASN 344 CO -0.03 0.43 0.03 -0.33 -1.06 0.00 0.00 177.43 176.47 3itl h GLU 345 N 0.44 0.48 -0.23 0.81 4.39 -0.60 0.11 114.58 119.99 3itl h GLU 345 Ca 0.12 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.68 3itl h GLU 345 Cb 0.08 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 3itl h GLU 345 CO -0.02 0.48 -0.06 0.82 -1.16 0.00 0.00 179.01 179.08 3itl h ILE 346 N 0.47 1.28 -0.08 3.13 2.04 -0.96 -1.48 117.51 121.92 3itl h ILE 346 Ca 0.11 -1.06 -0.08 0.00 1.00 0.00 0.00 64.86 64.83 3itl h ILE 346 Cb 0.25 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 3itl h ILE 346 CO 0.00 0.33 -0.31 0.03 0.00 0.00 0.00 178.15 178.20 3itl h ARG 347 N 0.19 0.15 0.02 2.37 3.08 -0.89 -2.11 114.38 117.19 3itl h ARG 347 Ca 0.06 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3itl h ARG 347 Cb 0.52 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3itl h ARG 347 CO 0.02 0.45 -0.01 -0.09 -1.07 0.00 0.00 179.97 179.28 3itl h ARG 348 N 0.14 -0.03 -0.81 0.04 2.43 -0.48 0.10 114.38 115.77 3itl h ARG 348 Ca 0.02 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3itl h ARG 348 Cb 0.62 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.14 3itl h ARG 348 CO 0.05 0.09 0.43 0.00 -1.51 0.00 0.00 179.97 179.03 3itl h ALA 349 N 0.83 1.25 -0.17 2.80 0.00 -1.11 -1.33 119.26 121.53 3itl h ALA 349 Ca -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3itl h ALA 349 Cb 0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3itl h ALA 349 CO 0.01 0.60 0.05 -0.92 0.00 0.00 0.00 179.25 178.99 3itl h TYR 350 N 1.13 0.27 -0.55 0.00 3.20 -1.15 -1.05 116.97 118.82 3itl h TYR 350 Ca 0.28 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.15 3itl h TYR 350 Cb 0.03 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 3itl h TYR 350 CO 0.01 0.37 0.34 0.00 -1.64 0.00 0.00 178.16 177.24 3itl h ALA 351 N 0.87 0.71 -0.57 1.82 0.00 -0.65 -1.18 119.26 120.27 3itl h ALA 351 Ca 0.05 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3itl h ALA 351 Cb 0.22 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3itl h ALA 351 CO -0.00 0.08 0.04 1.96 0.00 0.00 0.00 179.25 181.33 3itl h GLN 352 N 0.69 0.94 -0.23 0.00 4.20 -1.14 -2.02 115.11 117.55 3itl h GLN 352 Ca 0.21 -0.26 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 3itl h GLN 352 Cb -0.02 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 3itl h GLN 352 CO -0.08 0.91 -0.05 0.00 -0.67 0.00 0.00 178.83 178.94 3itl h ALA 353 N 1.16 1.50 0.00 3.87 0.00 -0.69 -1.41 119.26 123.69 3itl h ALA 353 Ca 0.17 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3itl h ALA 353 Cb 0.46 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3itl h ALA 353 CO 0.02 0.36 -0.15 -0.07 0.00 0.00 0.00 179.25 179.41 3itl h LEU 354 N 0.33 0.00 0.00 0.00 4.07 -0.50 -2.83 115.31 116.39 3itl h LEU 354 Ca 0.07 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.03 3itl h LEU 354 Cb 0.31 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.05 3itl h LEU 354 CO 0.01 0.15 -0.08 -0.07 -1.08 0.00 0.00 178.44 177.37 3itl h LEU 355 N 0.00 0.00 -9.59 1.67 3.38 -0.94 -3.46 115.31 106.37 3itl h LEU 355 Ca -0.00 -0.02 -0.54 0.00 0.09 0.00 0.00 57.88 57.40 3itl h LEU 355 Cb 0.46 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.26 3itl h LEU 355 CO 0.02 0.01 0.96 0.52 0.09 0.00 0.00 178.44 180.04 3itl n VAL 356 N -2.42 0.05 -2.56 1.22 0.31 -1.07 -4.81 118.33 109.04 3itl n VAL 356 Ca 0.05 -0.01 -0.41 0.00 -0.01 0.00 0.00 64.34 63.96 3itl n VAL 356 Cb 0.45 -1.86 -0.03 0.00 -0.91 0.00 0.00 33.84 31.49 3itl n VAL 356 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3itl s ASP 357 N 1.29 6.33 0.25 4.52 -1.08 -1.26 -4.87 116.67 121.85 3itl s ASP 357 Ca 0.77 -0.95 -0.06 0.00 -0.52 0.00 0.00 52.55 51.80 3itl s ASP 357 Cb -0.56 -2.56 0.29 0.00 -1.46 0.00 0.00 42.92 38.62 3itl s ASP 357 CO 0.35 -1.67 1.91 0.03 0.52 0.00 0.00 175.17 176.30 3itl h ARG 358 N 9.91 1.21 -0.23 4.34 2.47 -1.96 -0.70 114.38 129.42 3itl h ARG 358 Ca -0.05 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.59 3itl h ARG 358 Cb 1.03 -0.27 -0.01 0.00 -1.65 0.00 0.00 29.97 29.07 3itl h ARG 358 CO 1.35 0.80 0.09 0.00 0.56 0.00 0.00 179.97 182.77 3itl h ALA 359 N 1.38 0.30 -0.58 0.04 0.00 -1.99 0.55 119.26 118.96 3itl h ALA 359 Ca 0.37 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 3itl h ALA 359 Cb -0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3itl h ALA 359 CO -0.11 -0.10 0.29 0.00 0.00 0.00 0.00 179.25 179.34 3itl h ALA 360 N 0.93 0.75 -0.11 0.00 0.00 -1.92 -1.65 119.26 117.27 3itl h ALA 360 Ca 0.08 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3itl h ALA 360 Cb 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3itl h ALA 360 CO -0.01 0.30 0.06 1.25 0.00 0.00 0.00 179.25 180.85 3itl h LEU 361 N 0.79 0.14 -1.17 0.00 5.85 -0.91 -1.74 115.31 118.28 3itl h LEU 361 Ca 0.20 -0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.90 3itl h LEU 361 Cb 0.09 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.03 3itl h LEU 361 CO -0.03 0.20 0.58 -1.28 -0.34 0.00 0.00 178.44 177.57 3itl h SER 362 N 0.08 0.87 -0.19 1.25 0.87 -0.72 -0.56 113.55 115.16 3itl h SER 362 Ca 0.04 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 3itl h SER 362 Cb 0.09 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 3itl h SER 362 CO -0.01 0.54 0.06 1.23 -0.53 0.00 0.00 176.83 178.12 3itl h GLY 363 N 0.98 0.32 2.00 5.77 0.00 -0.87 -1.57 103.07 109.69 3itl h GLY 363 Ca 0.40 -0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.49 3itl h GLY 363 CO -0.16 0.18 -0.22 -0.97 0.00 0.00 0.00 176.54 175.37 3itl h TYR 364 N 0.13 0.00 -0.07 5.60 0.05 -0.71 -1.99 116.97 119.98 3itl h TYR 364 Ca 0.06 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.72 3itl h TYR 364 Cb 0.24 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.99 3itl h TYR 364 CO 0.00 0.22 -0.43 1.96 -1.05 0.00 0.00 178.16 178.86 3itl h GLN 365 N 0.00 0.41 -0.41 4.88 4.20 -0.88 0.66 115.11 123.98 3itl h GLN 365 Ca -0.00 -0.35 -0.07 0.00 0.06 0.00 0.00 58.65 58.29 3itl h GLN 365 Cb 0.56 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 3itl h GLN 365 CO 0.03 1.00 -0.02 0.93 -0.67 0.00 0.00 178.83 180.09 3itl h GLU 366 N -0.05 0.67 -0.03 1.46 4.39 -1.09 -2.46 114.58 117.47 3itl h GLU 366 Ca -0.03 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.49 3itl h GLU 366 Cb 1.10 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.66 3itl h GLU 366 CO 0.09 0.70 0.00 -0.25 -1.16 0.00 0.00 179.01 178.39 3itl n ASP 367 N -4.23 0.97 -3.69 1.42 10.43 -0.77 -4.93 116.55 115.75 3itl n ASP 367 Ca 0.02 -1.39 -0.26 0.00 2.57 0.00 0.00 54.79 55.74 3itl n ASP 367 Cb 0.29 -0.02 0.06 0.00 1.84 0.00 0.00 41.12 43.30 3itl n ASP 367 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3itl n ASN 368 N -0.22 -5.82 -4.30 -2.24 5.03 -0.89 -4.91 115.26 101.91 3itl n ASN 368 Ca 0.19 -0.61 -0.44 0.00 0.87 0.00 0.00 54.58 54.59 3itl n ASN 368 Cb 0.26 -4.69 0.00 0.00 -1.02 0.00 0.00 39.78 34.33 3itl n ASN 368 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 3itl n ASP 369 N -2.97 5.57 -0.31 6.41 4.64 0.17 -4.88 116.55 125.19 3itl n ASP 369 Ca 0.01 -3.08 0.03 0.00 -1.38 0.00 0.00 54.79 50.37 3itl n ASP 369 Cb 0.55 -1.41 0.17 0.00 -1.04 0.00 0.00 41.12 39.40 3itl n ASP 369 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3itl h ALA 370 N 6.55 1.25 -0.22 -1.67 0.00 -1.91 -1.10 119.26 122.15 3itl h ALA 370 Ca 0.22 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3itl h ALA 370 Cb 0.83 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3itl h ALA 370 CO 1.12 0.18 0.09 1.25 0.00 0.00 0.00 179.25 181.90 3itl h LEU 371 N 0.89 0.31 -0.70 0.00 6.46 -1.96 -1.54 115.31 118.77 3itl h LEU 371 Ca 0.41 -0.16 -0.10 0.00 -0.12 0.00 0.00 57.88 57.91 3itl h LEU 371 Cb 0.33 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.16 3itl h LEU 371 CO -0.23 0.39 -0.45 0.24 -0.62 0.00 0.00 178.44 177.77 3itl h MET 372 N 0.21 0.00 -0.24 1.25 2.86 -1.92 -1.40 114.93 115.69 3itl h MET 372 Ca 0.07 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.66 3itl h MET 372 Cb 0.18 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 3itl h MET 372 CO -0.01 0.45 -0.08 0.00 1.06 0.00 0.00 176.91 178.34 3itl h ALA 373 N 1.55 0.33 -0.14 6.32 0.00 -1.01 0.05 119.26 126.36 3itl h ALA 373 Ca -0.00 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.50 3itl h ALA 373 Cb 1.05 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3itl h ALA 373 CO 0.06 0.15 -0.47 0.00 0.00 0.00 0.00 179.25 178.99 3itl h THR 374 N 0.20 1.33 0.00 0.00 1.03 -1.22 -2.44 112.91 111.81 3itl h THR 374 Ca 0.06 -1.68 -0.08 0.00 -0.01 0.00 0.00 66.41 64.70 3itl h THR 374 Cb 0.56 1.74 -0.01 0.00 -1.07 0.00 0.00 68.15 69.37 3itl h THR 374 CO 0.03 0.51 -0.39 -0.08 -0.01 0.00 0.00 175.52 175.57 3itl h GLU 375 N 0.28 0.00 -0.32 0.00 4.57 -1.11 -0.89 114.58 117.11 3itl h GLU 375 Ca 0.02 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.08 3itl h GLU 375 Cb 0.94 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.51 3itl h GLU 375 CO 0.08 0.39 -0.29 1.15 -1.18 0.00 0.00 179.01 179.16 3itl h THR 376 N 0.00 1.28 -0.23 0.32 2.02 -0.51 0.25 112.91 116.04 3itl h THR 376 Ca -0.00 -1.40 -0.14 0.00 0.77 0.00 0.00 66.41 65.64 3itl h THR 376 Cb 0.76 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 3itl h THR 376 CO 0.05 0.45 -0.41 -0.07 0.37 0.00 0.00 175.52 175.91 3itl h LEU 377 N 0.57 0.76 -1.09 2.58 3.38 -1.16 -3.22 115.31 117.13 3itl h LEU 377 Ca 0.07 -0.54 -0.04 0.00 0.09 0.00 0.00 57.88 57.47 3itl h LEU 377 Cb 0.78 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 3itl h LEU 377 CO 0.06 1.15 0.21 0.11 0.09 0.00 0.00 178.44 180.06 3itl h LYS 378 N 0.39 0.86 -0.51 1.13 1.79 -0.91 -1.05 116.57 118.27 3itl h LYS 378 Ca 0.01 -0.14 0.07 0.00 -2.18 0.00 0.00 60.65 58.41 3itl h LYS 378 Cb 1.01 -0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 31.49 3itl h LYS 378 CO 0.09 0.72 0.34 0.00 -1.08 0.00 0.00 179.45 179.53 3itl h ARG 379 N 0.84 0.39 0.00 3.15 3.08 -0.96 0.50 114.38 121.40 3itl h ARG 379 Ca 0.20 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 3itl h ARG 379 Cb 0.20 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.16 3itl h ARG 379 CO -0.01 0.26 -0.03 0.00 -1.07 0.00 0.00 179.97 179.12 3itl h ALA 380 N 1.73 -0.00 -0.68 0.04 0.00 -1.46 -3.30 119.26 115.59 3itl h ALA 380 Ca 0.23 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3itl h ALA 380 Cb 0.37 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3itl h ALA 380 CO -0.06 -0.02 0.37 -0.92 0.00 0.00 0.00 179.25 178.62 3itl h TYR 381 N -0.91 0.92 0.00 0.00 3.20 -0.63 -2.27 116.97 117.28 3itl h TYR 381 Ca -0.00 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 3itl h TYR 381 Cb 0.96 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.93 3itl h TYR 381 CO 0.25 0.64 0.00 0.54 -1.64 0.00 0.00 178.16 177.96 3itl n ARG 382 N -4.37 0.16 -2.31 1.82 1.74 0.17 -4.75 116.66 109.12 3itl n ARG 382 Ca 0.07 0.35 -0.42 0.00 -0.77 0.00 0.00 57.85 57.07 3itl n ARG 382 Cb 0.10 -1.78 -0.03 0.00 -1.02 0.00 0.00 32.46 29.73 3itl n ARG 382 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3itl s THR 383 N -3.22 3.91 -0.65 0.55 2.01 -0.86 -4.96 115.64 112.43 3itl s THR 383 Ca 0.06 1.28 -0.28 0.00 0.31 0.00 0.00 61.69 63.06 3itl s THR 383 Cb 0.10 -3.82 0.03 0.00 0.01 0.00 0.00 72.50 68.82 3itl s THR 383 CO 0.40 -0.00 1.23 -0.62 -0.69 0.00 0.00 174.62 174.94 3itl s ASP 384 N 1.72 6.32 -0.01 3.53 2.15 -1.26 -4.86 116.67 124.27 3itl s ASP 384 Ca 0.61 -0.14 0.14 0.00 0.43 0.00 0.00 52.55 53.59 3itl s ASP 384 Cb -0.29 -2.56 0.43 0.00 -0.30 0.00 0.00 42.92 40.20 3itl s ASP 384 CO 0.25 -1.64 1.35 1.33 -0.17 0.00 0.00 175.17 176.29 3itl n VAL 385 N 6.54 0.70 -0.35 1.11 0.24 -1.26 -4.44 118.33 120.88 3itl n VAL 385 Ca 0.06 -0.65 0.09 0.00 -2.04 0.00 0.00 64.34 61.80 3itl n VAL 385 Cb 0.49 0.28 0.26 0.00 -1.47 0.00 0.00 33.84 33.40 3itl n VAL 385 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3itl h GLU 386 N 2.76 0.84 -0.60 7.34 4.57 -1.98 -0.13 114.58 127.39 3itl h GLU 386 Ca 0.00 -0.05 0.01 0.00 -1.18 0.00 0.00 59.36 58.14 3itl h GLU 386 Cb 0.68 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 29.05 3itl h GLU 386 CO 0.02 0.56 0.40 -1.35 -1.18 0.00 0.00 179.01 177.45 3itl h PRO 387 N 0.87 0.76 -0.24 0.92 0.11 -1.92 0.14 132.00 132.65 3itl h PRO 387 Ca 0.52 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.52 3itl h PRO 387 Cb 0.63 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 3itl h PRO 387 CO -0.31 0.51 -0.10 0.82 -0.21 0.00 0.00 178.00 178.71 3itl h ILE 388 N 0.79 1.30 -0.61 4.15 2.04 -1.38 -0.73 117.51 123.06 3itl h ILE 388 Ca 0.22 -1.15 -0.06 0.00 1.00 0.00 0.00 64.86 64.88 3itl h ILE 388 Cb -0.05 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 3itl h ILE 388 CO -0.05 0.36 0.16 -0.07 0.00 0.00 0.00 178.15 178.54 3itl h LEU 389 N 0.21 0.93 -0.48 1.44 3.38 -0.73 -0.88 115.31 119.17 3itl h LEU 389 Ca 0.06 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 3itl h LEU 389 Cb 0.58 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3itl h LEU 389 CO 0.03 0.91 -0.02 0.00 0.09 0.00 0.00 178.44 179.46 3itl h ALA 390 N 1.05 0.64 -0.33 1.53 0.00 -0.69 -2.35 119.26 119.11 3itl h ALA 390 Ca 0.19 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 3itl h ALA 390 Cb 0.35 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3itl h ALA 390 CO 0.00 0.46 -0.34 1.49 0.00 0.00 0.00 179.25 180.86 3itl h GLU 391 N 0.71 0.74 -0.70 0.00 4.57 -1.02 -0.93 114.58 117.95 3itl h GLU 391 Ca 0.13 -0.36 0.00 0.00 -1.18 0.00 0.00 59.36 57.96 3itl h GLU 391 Cb 0.53 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.09 3itl h GLU 391 CO 0.03 0.97 0.45 0.00 -1.18 0.00 0.00 179.01 179.28 3itl h ALA 392 N 0.99 0.89 -0.13 2.92 0.00 -1.07 -0.42 119.26 122.45 3itl h ALA 392 Ca 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3itl h ALA 392 Cb 0.88 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3itl h ALA 392 CO 0.08 0.33 0.02 0.00 0.00 0.00 0.00 179.25 179.68 3itl h ARG 393 N 0.95 0.21 -0.51 0.00 3.08 -1.19 -2.49 114.38 114.42 3itl h ARG 393 Ca 0.25 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.30 3itl h ARG 393 Cb -0.08 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 3itl h ARG 393 CO -0.05 0.39 0.26 -0.09 -1.07 0.00 0.00 179.97 179.41 3itl h ARG 394 N -0.01 0.49 0.00 0.04 2.43 -0.84 0.67 114.38 117.16 3itl h ARG 394 Ca 0.04 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 3itl h ARG 394 Cb 0.28 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 3itl h ARG 394 CO 0.00 0.33 -0.11 0.00 -1.51 0.00 0.00 179.97 178.68 3itl h ARG 395 N 0.51 0.00 -0.51 0.20 3.08 -1.05 -3.14 114.38 113.48 3itl h ARG 395 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 3itl h ARG 395 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3itl h ARG 395 CO -0.16 0.11 0.00 0.25 -1.07 0.00 0.00 179.97 179.10 3itl n THR 396 N -3.35 1.46 -0.27 2.04 -2.24 -0.81 -4.94 114.28 106.17 3itl n THR 396 Ca -0.01 -1.19 0.00 0.00 -2.27 0.00 0.00 64.05 60.58 3itl n THR 396 Cb 0.30 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 3itl n THR 396 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3itl n GLY 397 N 0.78 0.75 0.00 3.38 0.00 -0.99 -4.98 105.19 104.13 3itl n GLY 397 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3itl n GLY 397 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3itl n GLY 398 N -2.14 0.71 3.65 -0.02 0.00 0.23 -4.81 105.19 102.81 3itl n GLY 398 Ca 0.00 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.74 3itl n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3itl s ALA 399 N -2.81 3.24 0.17 4.61 0.00 -0.35 -4.22 121.76 122.40 3itl s ALA 399 Ca 0.00 -0.81 -0.15 0.00 0.00 0.00 0.00 51.96 51.00 3itl s ALA 399 Cb 0.00 -1.50 0.12 0.00 0.00 0.00 0.00 23.12 21.75 3itl s ALA 399 CO 0.00 0.52 1.70 0.28 0.00 0.00 0.00 175.76 178.26 3itl h VAL 400 N 4.33 0.71 -3.34 0.00 2.07 -1.88 -3.28 116.25 114.86 3itl h VAL 400 Ca -0.47 -0.05 -0.63 0.00 0.82 0.00 0.00 66.70 66.37 3itl h VAL 400 Cb 1.19 0.56 -0.40 0.00 -1.52 0.00 0.00 31.29 31.12 3itl h VAL 400 CO 0.56 0.02 -0.69 -0.62 0.02 0.00 0.00 177.57 176.86 3itl s ASP 401 N -5.27 4.24 0.14 0.57 -1.08 -1.26 -4.68 116.67 109.33 3itl s ASP 401 Ca -0.13 -2.53 -0.27 0.00 -0.52 0.00 0.00 52.55 49.10 3itl s ASP 401 Cb 0.14 -1.40 -0.02 0.00 -1.46 0.00 0.00 42.92 40.18 3itl s ASP 401 CO 0.71 -0.30 1.59 -0.65 0.52 0.00 0.00 175.17 177.04 3itl h PRO 402 N 7.04 -0.40 -0.67 4.34 0.11 -1.86 -1.30 132.00 139.26 3itl h PRO 402 Ca -0.06 0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.02 3itl h PRO 402 Cb 0.95 0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 3itl h PRO 402 CO 0.57 -0.27 0.17 0.28 -0.21 0.00 0.00 178.00 178.54 3itl h VAL 403 N -0.42 1.25 -0.51 3.15 2.07 -1.94 0.24 116.25 120.09 3itl h VAL 403 Ca 0.10 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 3itl h VAL 403 Cb 0.59 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 3itl h VAL 403 CO -0.41 0.35 0.31 0.00 0.02 0.00 0.00 177.57 177.83 3itl h ALA 404 N 1.19 0.65 -0.60 1.67 0.00 -1.93 -0.56 119.26 119.68 3itl h ALA 404 Ca 0.21 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 3itl h ALA 404 Cb 0.33 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3itl h ALA 404 CO -0.00 0.14 -0.01 1.15 0.00 0.00 0.00 179.25 180.52 3itl h THR 405 N 0.69 1.27 -0.40 0.00 2.02 -0.97 -0.97 112.91 114.55 3itl h THR 405 Ca 0.18 -1.17 0.02 0.00 0.77 0.00 0.00 66.41 66.22 3itl h THR 405 Cb -0.01 0.83 -0.03 0.00 -1.74 0.00 0.00 68.15 67.20 3itl h THR 405 CO -0.03 0.42 0.22 0.22 0.37 0.00 0.00 175.52 176.71 3itl h TYR 406 N 0.96 0.40 -0.39 3.16 3.20 -0.51 -1.00 116.97 122.79 3itl h TYR 406 Ca 0.17 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.92 3itl h TYR 406 Cb 0.58 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 3itl h TYR 406 CO 0.04 0.22 -0.28 0.00 -1.64 0.00 0.00 178.16 176.50 3itl h ARG 407 N 0.44 0.83 0.00 1.82 3.08 -0.94 -2.86 114.38 116.74 3itl h ARG 407 Ca 0.17 -0.37 -0.04 0.00 0.07 0.00 0.00 59.98 59.81 3itl h ARG 407 Cb 0.05 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 3itl h ARG 407 CO -0.10 1.00 -0.18 0.00 -1.07 0.00 0.00 179.97 179.62 3itl h ALA 408 N 0.98 1.68 0.00 0.04 0.00 -0.74 -2.56 119.26 118.65 3itl h ALA 408 Ca 0.08 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3itl h ALA 408 Cb 0.82 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 3itl h ALA 408 CO 0.07 0.23 -0.21 0.66 0.00 0.00 0.00 179.25 180.00 3itl h SER 409 N 0.00 0.00 -0.53 0.00 4.64 -0.96 -3.47 113.55 113.24 3itl h SER 409 Ca -0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 3itl h SER 409 Cb 0.32 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.35 3itl h SER 409 CO 0.02 0.21 -0.18 0.61 -0.87 0.00 0.00 176.83 176.63 3itl n GLY 410 N 0.54 0.96 0.17 -0.77 0.00 -0.97 -4.93 105.19 100.19 3itl n GLY 410 Ca 0.01 -0.61 -0.04 0.00 0.00 0.00 0.00 46.02 45.38 3itl n GLY 410 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3itl h TYR 411 N 0.00 -0.01 -0.49 1.61 3.20 -1.85 -1.47 116.97 117.97 3itl h TYR 411 Ca -0.19 0.03 0.07 0.00 3.14 0.00 0.00 58.73 61.78 3itl h TYR 411 Cb 0.65 0.06 -0.06 0.00 1.54 0.00 0.00 36.73 38.93 3itl h TYR 411 CO 0.25 -0.07 0.15 -0.09 -1.64 0.00 0.00 178.16 176.76 3itl h ARG 412 N 0.12 0.30 -0.45 1.82 9.65 -1.92 -0.35 114.38 123.54 3itl h ARG 412 Ca 0.20 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 59.01 3itl h ARG 412 Cb 0.28 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.77 3itl h ARG 412 CO -0.32 0.20 0.09 0.00 2.80 0.00 0.00 179.97 182.74 3itl h ALA 413 N 1.35 1.32 0.26 2.80 0.00 -1.87 -1.09 119.26 122.03 3itl h ALA 413 Ca 0.24 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3itl h ALA 413 Cb 0.28 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3itl h ALA 413 CO -0.27 0.48 -0.13 -0.09 0.00 0.00 0.00 179.25 179.24 3itl h ARG 414 N 0.66 -0.34 0.00 0.00 2.43 -0.06 -2.09 114.38 114.98 3itl h ARG 414 Ca 0.15 0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.29 3itl h ARG 414 Cb 0.27 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 3itl h ARG 414 CO -0.00 -0.15 -0.24 -0.39 -1.51 0.00 0.00 179.97 177.68 3itl h VAL 415 N -0.45 0.73 -0.23 0.20 -1.51 -1.01 -2.03 116.25 111.94 3itl h VAL 415 Ca -0.04 -1.00 -0.09 0.00 -1.23 0.00 0.00 66.70 64.34 3itl h VAL 415 Cb 0.34 1.63 -0.01 0.00 -2.13 0.00 0.00 31.29 31.12 3itl h VAL 415 CO 0.06 0.23 -0.26 0.00 -1.23 0.00 0.00 177.57 176.37 3itl h ALA 416 N 1.76 1.12 0.00 5.19 0.00 -0.98 0.15 119.26 126.50 3itl h ALA 416 Ca -0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 3itl h ALA 416 Cb 0.61 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3itl h ALA 416 CO 0.03 0.55 -0.07 0.00 0.00 0.00 0.00 179.25 179.76 3itl h ALA 417 N 1.33 0.97 0.00 0.00 0.00 -0.67 -3.23 119.26 117.67 3itl h ALA 417 Ca 0.06 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 3itl h ALA 417 Cb 0.67 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3itl h ALA 417 CO 0.05 0.09 -1.75 0.39 0.00 0.00 0.00 179.25 178.03 3itl n GLU 418 N -3.14 0.65 -4.51 0.00 1.02 -0.93 -4.92 120.64 108.80 3itl n GLU 418 Ca 0.02 0.01 -0.33 0.00 -0.02 0.00 0.00 57.16 56.84 3itl n GLU 418 Cb 0.47 -1.65 -0.13 0.00 -0.02 0.00 0.00 31.44 30.10 3itl n GLU 418 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3itl s ARG 419 N -3.12 3.56 -0.03 3.49 0.52 -0.00 -5.09 118.95 118.27 3itl s ARG 419 Ca -0.06 -0.58 -0.30 0.00 -0.52 0.00 0.00 55.73 54.27 3itl s ARG 419 Cb 0.10 -2.82 -0.03 0.00 0.52 0.00 0.00 34.95 32.72 3itl s ARG 419 CO 0.85 0.21 1.04 -2.14 0.02 0.00 0.00 175.30 175.28 3itl s PRO 420 N 0.41 4.48 0.76 3.54 0.02 -1.26 -4.65 135.00 138.30 3itl s PRO 420 Ca -0.06 1.48 -0.08 0.00 0.02 0.00 0.00 61.00 62.36 3itl s PRO 420 Cb -0.15 -3.48 0.09 0.00 0.02 0.00 0.00 34.50 30.99 3itl s PRO 420 CO 0.04 -0.19 1.08 0.00 -0.33 0.00 0.00 177.00 177.60 3itl s ALA 421 N 1.41 3.02 0.36 -1.55 0.00 -1.26 -4.94 121.76 118.80 3itl s ALA 421 Ca 0.52 -1.03 0.09 0.00 0.00 0.00 0.00 51.96 51.55 3itl s ALA 421 Cb -0.22 -2.60 0.70 0.00 0.00 0.00 0.00 23.12 21.01 3itl s ALA 421 CO 0.25 -1.53 1.86 0.77 0.00 0.00 0.00 175.76 177.10 3itl h SER 422 N -0.80 0.21 -4.72 0.00 0.02 -1.97 -3.43 113.55 102.85 3itl h SER 422 Ca -0.44 -0.05 -0.14 0.00 -0.84 0.00 0.00 61.79 60.32 3itl h SER 422 Cb 1.30 -0.06 -0.22 0.00 0.14 0.00 0.00 62.40 63.57 3itl h SER 422 CO 0.55 0.44 -0.42 -0.69 -1.14 0.00 0.00 176.83 175.57 3itl s VAL 423 N -4.54 0.06 -1.53 2.27 1.01 -1.26 -5.33 120.40 111.08 3itl s VAL 423 Ca -0.05 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.45 3itl s VAL 423 Cb 0.15 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 36.07 3itl s VAL 423 CO 0.74 -0.26 0.38 0.00 0.00 0.00 0.00 175.10 175.96