#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ito h ARG 5 N 0.00 1.10 -5.37 -1.08 2.47 -1.93 -3.40 114.38 106.17 3ito h ARG 5 Ca 0.00 -0.14 -0.64 0.00 -1.26 0.00 0.00 59.98 57.94 3ito h ARG 5 Cb 0.00 -0.21 -0.20 0.00 -1.65 0.00 0.00 29.97 27.91 3ito h ARG 5 CO 0.00 0.83 -0.64 0.42 0.56 0.00 0.00 179.97 181.14 3ito s ILE 6 N -5.66 4.08 0.18 2.04 -1.09 -1.26 -5.02 121.20 114.47 3ito s ILE 6 Ca -0.12 -0.29 -0.33 0.00 -2.23 0.00 0.00 60.65 57.69 3ito s ILE 6 Cb 0.17 -2.79 -0.12 0.00 -1.58 0.00 0.00 42.46 38.13 3ito s ILE 6 CO 0.81 0.50 1.70 0.00 -1.23 0.00 0.00 174.94 176.72 3ito n ALA 7 N 3.39 2.29 -0.30 9.38 0.00 -1.26 -4.88 120.51 129.13 3ito n ALA 7 Ca -0.17 0.40 0.07 0.00 0.00 0.00 0.00 53.44 53.74 3ito n ALA 7 Cb 0.52 -2.48 0.28 0.00 0.00 0.00 0.00 19.45 17.78 3ito n ALA 7 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3ito h GLN 8 N 6.75 0.89 -0.20 0.00 4.20 -1.97 -1.22 115.11 123.56 3ito h GLN 8 Ca -0.44 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.19 3ito h GLN 8 Cb 1.22 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.79 3ito h GLN 8 CO 0.94 0.59 -0.00 0.38 -0.67 0.00 0.00 178.83 180.06 3ito h ASP 9 N 0.92 0.27 -0.22 1.46 2.03 -1.99 -0.62 116.42 118.27 3ito h ASP 9 Ca 0.42 -0.03 -0.12 0.00 -0.73 0.00 0.00 57.03 56.57 3ito h ASP 9 Cb 0.39 -0.07 -0.00 0.00 -0.83 0.00 0.00 39.33 38.82 3ito h ASP 9 CO -0.18 0.32 -0.33 0.58 -1.03 0.00 0.00 179.24 178.60 3ito h VAL 10 N 0.29 1.32 -0.48 4.15 2.07 -1.61 -0.97 116.25 121.02 3ito h VAL 10 Ca 0.07 -1.54 -0.02 0.00 0.82 0.00 0.00 66.70 66.03 3ito h VAL 10 Cb 0.21 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 3ito h VAL 10 CO 0.00 0.48 0.22 0.58 0.02 0.00 0.00 177.57 178.88 3ito h VAL 11 N 0.30 1.20 -0.48 2.57 2.07 -1.07 -0.08 116.25 120.76 3ito h VAL 11 Ca 0.02 -0.57 -0.05 0.00 0.82 0.00 0.00 66.70 66.93 3ito h VAL 11 Cb 0.92 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 3ito h VAL 11 CO 0.08 0.22 0.12 0.00 0.02 0.00 0.00 177.57 178.01 3ito h ALA 12 N 1.07 0.63 -0.33 1.67 0.00 -1.12 -1.58 119.26 119.59 3ito h ALA 12 Ca 0.17 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3ito h ALA 12 Cb 0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3ito h ALA 12 CO -0.02 0.32 0.14 -0.09 0.00 0.00 0.00 179.25 179.60 3ito h ARG 13 N 0.65 0.49 0.00 0.00 2.43 -0.90 -0.57 114.38 116.47 3ito h ARG 13 Ca 0.15 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 3ito h ARG 13 Cb 0.32 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 3ito h ARG 13 CO 0.00 0.47 0.00 0.93 -1.51 0.00 0.00 179.97 179.86 3ito h GLU 14 N 0.39 0.00 0.09 0.20 4.39 -0.95 -2.23 114.58 116.47 3ito h GLU 14 Ca 0.11 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.66 3ito h GLU 14 Cb 0.15 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.81 3ito h GLU 14 CO -0.01 0.00 -0.70 -0.91 -1.16 0.00 0.00 179.01 176.23 3ito h ASN 15 N 0.00 0.29 -0.52 1.42 -0.26 -0.87 -3.28 115.58 112.36 3ito h ASN 15 Ca 0.00 -0.92 -0.00 0.00 -0.56 0.00 0.00 56.30 54.81 3ito h ASN 15 Cb 0.57 -0.09 -0.03 0.00 -1.06 0.00 0.00 38.32 37.71 3ito h ASN 15 CO 0.00 1.32 0.31 0.44 -1.06 0.00 0.00 177.43 178.44 3ito h ASP 16 N -0.59 0.64 0.24 5.81 3.32 -1.03 0.13 116.42 124.94 3ito h ASP 16 Ca -0.14 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 56.87 3ito h ASP 16 Cb 1.45 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.84 3ito h ASP 16 CO 0.07 0.50 -0.04 -0.09 -1.72 0.00 0.00 179.24 177.96 3ito h ARG 17 N 0.73 0.00 -0.03 3.56 2.43 -1.50 -2.80 114.38 116.78 3ito h ARG 17 Ca 0.19 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 3ito h ARG 17 Cb -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 3ito h ARG 17 CO -0.04 0.04 0.00 0.54 -1.51 0.00 0.00 179.97 179.01 3ito n ARG 18 N -3.46 0.34 -0.14 0.20 1.74 -0.38 -4.76 116.66 110.21 3ito n ARG 18 Ca -0.02 -0.92 -0.08 0.00 -0.77 0.00 0.00 57.85 56.06 3ito n ARG 18 Cb 0.16 -1.06 0.01 0.00 -1.02 0.00 0.00 32.46 30.55 3ito n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ito h ALA 19 N 0.52 0.55 0.47 7.54 0.00 -0.52 -2.26 119.26 125.55 3ito h ALA 19 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3ito h ALA 19 Cb 0.23 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3ito h ALA 19 CO 0.00 0.01 -0.29 1.03 0.00 0.00 0.00 179.25 180.01 3ito h SER 20 N 0.58 -0.72 -0.96 0.00 0.87 -1.86 -0.18 113.55 111.28 3ito h SER 20 Ca 0.16 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.79 3ito h SER 20 Cb -0.05 0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 62.07 3ito h SER 20 CO -0.03 -0.46 0.63 0.00 -0.53 0.00 0.00 176.83 176.44 3ito h ALA 21 N -0.24 1.25 -0.73 6.23 0.00 -1.90 -2.03 119.26 121.85 3ito h ALA 21 Ca -0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3ito h ALA 21 Cb 0.59 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3ito h ALA 21 CO 0.05 0.53 0.41 1.25 0.00 0.00 0.00 179.25 181.50 3ito h LEU 22 N 1.23 0.90 -0.44 0.00 5.85 -1.16 -0.93 115.31 120.77 3ito h LEU 22 Ca 0.37 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 59.04 3ito h LEU 22 Cb -0.04 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.73 3ito h LEU 22 CO -0.11 0.73 0.24 0.50 -0.34 0.00 0.00 178.44 179.45 3ito h LYS 23 N 1.01 0.46 0.20 1.25 3.64 -0.35 0.14 116.57 122.92 3ito h LYS 23 Ca 0.26 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 3ito h LYS 23 Cb 0.01 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 3ito h LYS 23 CO -0.04 0.31 -0.10 0.93 -2.27 0.00 0.00 179.45 178.28 3ito h GLU 24 N 0.48 -0.26 -0.50 1.90 4.39 -0.90 -1.64 114.58 118.05 3ito h GLU 24 Ca 0.18 0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.87 3ito h GLU 24 Cb 0.06 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 3ito h GLU 24 CO -0.11 -0.16 0.19 -0.44 -1.16 0.00 0.00 179.01 177.34 3ito h ASP 25 N -0.29 0.69 -0.59 1.42 3.32 -0.94 -0.72 116.42 119.31 3ito h ASP 25 Ca -0.03 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 56.82 3ito h ASP 25 Cb 0.22 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 3ito h ASP 25 CO 0.05 0.67 0.26 0.22 -1.72 0.00 0.00 179.24 178.72 3ito h TYR 26 N 0.66 0.87 -0.44 4.55 3.20 -0.69 -0.11 116.97 125.01 3ito h TYR 26 Ca 0.16 -0.05 -0.08 0.00 3.14 0.00 0.00 58.73 61.90 3ito h TYR 26 Cb 0.20 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 3ito h TYR 26 CO 0.01 0.68 -0.06 0.93 -1.64 0.00 0.00 178.16 178.08 3ito h GLU 27 N 0.80 0.81 -0.44 1.82 5.08 -1.17 0.13 114.58 121.61 3ito h GLU 27 Ca 0.20 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 3ito h GLU 27 Cb 0.16 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 3ito h GLU 27 CO -0.02 0.90 0.24 0.00 -1.00 0.00 0.00 179.01 179.13 3ito h ALA 28 N 0.88 0.57 -0.32 3.43 0.00 -0.89 -0.67 119.26 122.26 3ito h ALA 28 Ca 0.12 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3ito h ALA 28 Cb 0.58 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3ito h ALA 28 CO 0.03 0.10 -0.24 1.25 0.00 0.00 0.00 179.25 180.39 3ito h LEU 29 N 0.58 0.63 -1.20 0.00 5.85 -0.90 -1.17 115.31 119.09 3ito h LEU 29 Ca 0.15 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 3ito h LEU 29 Cb 0.07 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 3ito h LEU 29 CO -0.02 0.86 0.08 1.23 -0.34 0.00 0.00 178.44 180.25 3ito h GLY 30 N 1.00 0.68 0.55 3.75 0.00 -0.27 0.18 103.07 108.96 3ito h GLY 30 Ca 0.08 -0.38 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 3ito h GLY 30 CO 0.05 0.35 -0.09 0.00 0.00 0.00 0.00 176.54 176.86 3ito h ALA 31 N 1.48 0.07 -0.82 3.60 0.00 -0.70 -1.24 119.26 121.65 3ito h ALA 31 Ca 0.14 -0.32 0.03 0.00 0.00 0.00 0.00 54.91 54.76 3ito h ALA 31 Cb 0.27 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3ito h ALA 31 CO 0.00 -0.07 0.53 -0.97 0.00 0.00 0.00 179.25 178.74 3ito h ASN 32 N -0.37 0.87 -0.47 0.00 -0.73 -1.02 -1.05 115.58 112.80 3ito h ASN 32 Ca 0.00 -0.00 -0.10 0.00 1.87 0.00 0.00 56.30 58.07 3ito h ASN 32 Cb 0.67 -0.19 -0.02 0.00 0.27 0.00 0.00 38.32 39.04 3ito h ASN 32 CO 0.02 0.60 -0.08 -0.07 -0.37 0.00 0.00 177.43 177.53 3ito h LEU 33 N 1.02 0.93 -0.91 0.34 3.38 -0.97 -2.72 115.31 116.38 3ito h LEU 33 Ca 0.33 -0.28 0.01 0.00 0.09 0.00 0.00 57.88 58.02 3ito h LEU 33 Cb 0.01 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.46 3ito h LEU 33 CO -0.11 1.03 0.59 0.00 0.09 0.00 0.00 178.44 180.04 3ito h ALA 34 N 1.05 1.16 0.00 1.53 0.00 -0.34 0.19 119.26 122.85 3ito h ALA 34 Ca 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3ito h ALA 34 Cb 0.61 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3ito h ALA 34 CO 0.04 0.57 0.00 0.00 0.00 0.00 0.00 179.25 179.86 3ito h ARG 35 N 1.24 0.00 -0.48 0.00 3.08 -0.95 -0.78 114.38 116.49 3ito h ARG 35 Ca 0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.38 3ito h ARG 35 Cb -0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.93 3ito h ARG 35 CO -0.07 0.00 0.00 0.54 -1.07 0.00 0.00 179.97 179.37 3ito n ARG 36 N -2.83 2.44 -1.07 0.04 1.74 0.41 -4.93 116.66 112.45 3ito n ARG 36 Ca -0.00 -2.20 -0.03 0.00 -0.77 0.00 0.00 57.85 54.85 3ito n ARG 36 Cb 0.20 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.12 3ito n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ito n GLY 37 N 1.49 0.58 3.55 -0.13 0.00 -0.30 -5.02 105.19 105.36 3ito n GLY 37 Ca 0.20 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 3ito n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ito s VAL 38 N -2.01 3.81 -0.49 1.61 1.01 0.22 -4.98 120.40 119.56 3ito s VAL 38 Ca 0.00 -0.42 -0.18 0.00 0.00 0.00 0.00 61.98 61.38 3ito s VAL 38 Cb 0.00 -2.60 0.06 0.00 0.00 0.00 0.00 36.38 33.84 3ito s VAL 38 CO 0.00 0.56 0.55 -0.62 0.00 0.00 0.00 175.10 175.58 3ito s ASP 39 N -0.33 6.20 0.30 3.32 2.15 -1.26 -2.93 116.67 124.12 3ito s ASP 39 Ca 0.05 -1.01 0.06 0.00 0.43 0.00 0.00 52.55 52.07 3ito s ASP 39 Cb -0.12 -2.26 0.74 0.00 -0.30 0.00 0.00 42.92 40.98 3ito s ASP 39 CO 0.02 -0.80 1.76 -0.29 -0.17 0.00 0.00 175.17 175.69 3ito h ILE 40 N 5.82 0.66 -0.79 4.11 2.10 -1.92 -1.15 117.51 126.34 3ito h ILE 40 Ca -0.28 -0.24 0.07 0.00 1.08 0.00 0.00 64.86 65.49 3ito h ILE 40 Cb 1.10 -0.09 -0.05 0.00 -1.09 0.00 0.00 36.82 36.69 3ito h ILE 40 CO 0.93 0.13 0.51 -0.33 -1.08 0.00 0.00 178.15 178.31 3ito h GLU 41 N 0.70 0.80 -0.47 2.19 4.39 -1.98 0.59 114.58 120.81 3ito h GLU 41 Ca 0.58 -0.05 -0.08 0.00 0.34 0.00 0.00 59.36 60.15 3ito h GLU 41 Cb 0.94 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 29.39 3ito h GLU 41 CO -0.41 0.53 -0.04 0.00 -1.16 0.00 0.00 179.01 177.93 3ito h ALA 42 N 1.58 1.05 -0.14 3.43 0.00 -1.63 -0.35 119.26 123.20 3ito h ALA 42 Ca 0.34 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3ito h ALA 42 Cb 0.27 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3ito h ALA 42 CO -0.12 0.59 -0.19 0.28 0.00 0.00 0.00 179.25 179.81 3ito h VAL 43 N 0.74 1.36 -0.90 0.00 2.07 -1.14 -3.02 116.25 115.36 3ito h VAL 43 Ca 0.14 -1.40 0.01 0.00 0.82 0.00 0.00 66.70 66.26 3ito h VAL 43 Cb 0.51 1.96 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 3ito h VAL 43 CO 0.03 0.41 0.58 0.74 0.02 0.00 0.00 177.57 179.35 3ito h THR 44 N -0.03 1.24 -0.52 2.57 2.02 -0.74 -0.71 112.91 116.74 3ito h THR 44 Ca 0.01 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.74 3ito h THR 44 Cb 0.75 -0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 3ito h THR 44 CO 0.04 0.23 0.30 0.00 0.37 0.00 0.00 175.52 176.46 3ito h ALA 45 N 1.32 1.53 0.19 6.16 0.00 -1.07 -1.92 119.26 125.48 3ito h ALA 45 Ca 0.33 -0.08 -0.31 0.00 0.00 0.00 0.00 54.91 54.85 3ito h ALA 45 Cb -0.12 -0.21 0.03 0.00 0.00 0.00 0.00 17.79 17.48 3ito h ALA 45 CO -0.07 0.39 -1.36 0.87 0.00 0.00 0.00 179.25 179.09 3ito h LYS 46 N 0.72 0.54 -0.52 0.00 1.57 -1.30 -3.33 116.57 114.26 3ito h LYS 46 Ca 0.19 -0.83 0.00 0.00 -1.87 0.00 0.00 60.65 58.14 3ito h LYS 46 Cb 0.01 0.30 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 3ito h LYS 46 CO -0.03 1.39 0.34 0.28 -0.57 0.00 0.00 179.45 180.85 3ito h VAL 47 N 0.19 1.14 0.00 0.50 2.07 -0.85 -1.56 116.25 117.73 3ito h VAL 47 Ca -0.21 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3ito h VAL 47 Cb 2.04 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 3ito h VAL 47 CO 0.25 0.13 0.00 -1.84 0.02 0.00 0.00 177.57 176.14 3ito n GLU 48 N -4.72 0.11 0.00 1.57 0.28 -0.75 -1.48 120.64 115.65 3ito n GLU 48 Ca 0.03 0.23 0.06 0.00 -0.16 0.00 0.00 57.16 57.31 3ito n GLU 48 Cb 0.03 -1.50 0.05 0.00 1.43 0.00 0.00 31.44 31.44 3ito n GLU 48 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3ito n LYS 49 N -1.33 0.59 -2.83 3.44 4.76 -0.62 -4.94 118.16 117.22 3ito n LYS 49 Ca 0.04 -1.16 -0.42 0.00 -2.87 0.00 0.00 58.31 53.90 3ito n LYS 49 Cb 0.08 -1.21 -0.04 0.00 -1.84 0.00 0.00 35.03 32.02 3ito n LYS 49 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 3ito s PHE 50 N -0.94 3.18 0.17 2.13 5.36 -0.55 -5.03 117.98 122.29 3ito s PHE 50 Ca 0.13 0.95 0.10 0.00 -0.96 0.00 0.00 56.93 57.15 3ito s PHE 50 Cb 0.09 -3.40 -0.04 0.00 -0.34 0.00 0.00 43.02 39.33 3ito s PHE 50 CO 0.14 -0.65 -0.17 -0.06 -1.46 0.00 0.00 175.22 173.03 3ito s PHE 51 N 3.22 2.50 -0.02 10.12 0.08 -1.26 -4.76 117.98 127.85 3ito s PHE 51 Ca 0.37 -0.28 -0.00 0.00 0.12 0.00 0.00 56.93 57.14 3ito s PHE 51 Cb -0.13 -1.26 0.03 0.00 -0.57 0.00 0.00 43.02 41.09 3ito s PHE 51 CO 0.14 0.47 0.04 0.54 -0.10 0.00 0.00 175.22 176.31 3ito s VAL 52 N -1.53 -0.05 0.34 -0.44 0.11 -0.41 -4.80 120.40 113.62 3ito s VAL 52 Ca 0.21 0.18 -0.28 0.00 -2.93 0.00 0.00 61.98 59.17 3ito s VAL 52 Cb -0.09 -0.09 -0.09 0.00 -1.53 0.00 0.00 36.38 34.57 3ito s VAL 52 CO 0.12 0.07 1.20 0.00 -3.33 0.00 0.00 175.10 173.16 3ito s ALA 53 N 0.92 3.36 -0.17 1.54 0.00 -0.10 -4.25 121.76 123.05 3ito s ALA 53 Ca -0.08 1.06 -0.09 0.00 0.00 0.00 0.00 51.96 52.86 3ito s ALA 53 Cb -0.11 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.56 3ito s ALA 53 CO -0.03 -0.47 0.13 0.08 0.00 0.00 0.00 175.76 175.47 3ito s VAL 54 N -1.24 5.42 0.06 0.00 1.01 -0.60 -0.54 120.40 124.52 3ito s VAL 54 Ca 0.50 0.19 -0.30 0.00 0.00 0.00 0.00 61.98 62.37 3ito s VAL 54 Cb -0.35 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.56 3ito s VAL 54 CO 0.45 0.51 1.09 -2.16 0.00 0.00 0.00 175.10 174.99 3ito s PRO 55 N -0.20 4.53 0.43 2.72 0.04 -1.24 -1.00 135.00 140.27 3ito s PRO 55 Ca 0.11 1.61 0.11 0.00 0.04 0.00 0.00 61.00 62.87 3ito s PRO 55 Cb -0.11 -3.38 0.98 0.00 0.04 0.00 0.00 34.50 32.03 3ito s PRO 55 CO 0.00 -0.09 2.02 0.66 0.04 0.00 0.00 177.00 179.64 3ito h SER 56 N 6.40 0.39 -0.01 6.66 4.64 -1.57 0.23 113.55 130.29 3ito h SER 56 Ca -0.42 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3ito h SER 56 Cb 1.22 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3ito h SER 56 CO 0.77 0.25 0.00 -2.67 -0.87 0.00 0.00 176.83 174.31 3ito n TRP 57 N -4.47 0.01 0.22 4.77 2.14 -1.26 -3.62 117.44 115.22 3ito n TRP 57 Ca 0.06 -0.01 0.12 0.00 2.07 0.00 0.00 57.50 59.74 3ito n TRP 57 Cb 0.23 0.00 0.06 0.00 -0.81 0.00 0.00 31.31 30.80 3ito n TRP 57 CO 0.00 0.00 0.00 0.78 2.07 0.00 0.00 177.69 180.54 3ito h GLY 58 N 5.13 0.00 1.75 -1.67 0.00 -1.23 -3.34 103.07 103.71 3ito h GLY 58 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ito h GLY 58 CO 0.00 0.00 -0.05 3.33 0.00 0.00 0.00 176.54 179.82 3ito n VAL 59 N -2.63 0.00 -3.52 4.60 0.24 -1.24 -4.73 118.33 111.04 3ito n VAL 59 Ca 0.01 -0.00 -0.28 0.00 -2.04 0.00 0.00 64.34 62.03 3ito n VAL 59 Cb 0.52 -0.41 -0.03 0.00 -1.47 0.00 0.00 33.84 32.45 3ito n VAL 59 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3ito s GLY 60 N -2.87 1.84 0.22 7.63 0.00 -1.25 -4.64 107.32 108.23 3ito s GLY 60 Ca 0.18 -0.69 -0.30 0.00 0.00 0.00 0.00 44.72 43.91 3ito s GLY 60 CO 0.53 -0.62 1.35 -1.59 0.00 0.00 0.00 173.10 172.77 3ito s THR 61 N -1.97 3.02 0.64 0.90 2.01 -1.26 -4.63 115.64 114.35 3ito s THR 61 Ca 0.41 0.85 -0.00 0.00 0.31 0.00 0.00 61.69 63.26 3ito s THR 61 Cb -0.11 -3.54 0.08 0.00 0.01 0.00 0.00 72.50 68.94 3ito s THR 61 CO 0.29 0.13 0.89 -0.83 -0.69 0.00 0.00 174.62 174.41 3ito s GLY 62 N 0.34 1.79 0.37 4.40 0.00 -0.21 -4.94 107.32 109.07 3ito s GLY 62 Ca 0.58 -1.47 -0.07 0.00 0.00 0.00 0.00 44.72 43.76 3ito s GLY 62 CO 0.40 -1.05 0.61 -0.32 0.00 0.00 0.00 173.10 172.74 3ito s GLY 63 N -4.57 1.09 0.52 0.20 0.00 -1.26 -4.23 107.32 99.07 3ito s GLY 63 Ca 0.61 -1.24 0.03 0.00 0.00 0.00 0.00 44.72 44.12 3ito s GLY 63 CO 0.41 -0.73 0.14 -0.51 0.00 0.00 0.00 173.10 172.41 3ito s THR 64 N -2.64 1.31 -0.99 0.90 -4.23 -0.22 -5.00 115.64 104.78 3ito s THR 64 Ca 0.25 -1.82 0.12 0.00 -1.18 0.00 0.00 61.69 59.05 3ito s THR 64 Cb -0.02 -2.14 0.10 0.00 1.34 0.00 0.00 72.50 71.77 3ito s THR 64 CO 0.17 0.00 1.37 -2.11 -0.54 0.00 0.00 174.62 173.51 3ito n ARG 65 N -1.44 0.00 -0.05 3.99 1.85 -1.26 -2.68 116.66 117.08 3ito n ARG 65 Ca -0.13 0.31 -0.15 0.00 -1.00 0.00 0.00 57.85 56.88 3ito n ARG 65 Cb 0.66 -1.51 -0.14 0.00 -1.05 0.00 0.00 32.46 30.42 3ito n ARG 65 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3ito n PHE 66 N -1.52 0.74 -3.61 2.89 3.72 -1.26 -5.05 117.46 113.37 3ito n PHE 66 Ca 0.03 0.21 -0.03 0.00 -0.05 0.00 0.00 57.45 57.60 3ito n PHE 66 Cb 0.13 -1.11 -0.01 0.00 -0.94 0.00 0.00 39.48 37.54 3ito n PHE 66 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3ito s ALA 67 N -2.55 -2.02 -0.05 4.37 0.00 -1.09 -5.14 121.76 115.28 3ito s ALA 67 Ca -0.16 1.00 -0.01 0.00 0.00 0.00 0.00 51.96 52.79 3ito s ALA 67 Cb 0.07 0.23 0.03 0.00 0.00 0.00 0.00 23.12 23.46 3ito s ALA 67 CO 0.77 -0.82 0.02 0.50 0.00 0.00 0.00 175.76 176.24 3ito s ARG 68 N -2.67 0.26 -0.69 0.00 3.52 -1.26 -1.05 118.95 117.05 3ito s ARG 68 Ca 0.11 0.21 -0.01 0.00 -0.13 0.00 0.00 55.73 55.90 3ito s ARG 68 Cb 0.01 -0.67 0.17 0.00 -1.56 0.00 0.00 34.95 32.91 3ito s ARG 68 CO -0.04 -0.27 0.51 -0.06 -0.81 0.00 0.00 175.30 174.63 3ito s PHE 69 N 1.81 3.51 0.65 5.12 0.08 -1.26 -5.06 117.98 122.83 3ito s PHE 69 Ca 0.01 -2.93 -0.18 0.00 0.12 0.00 0.00 56.93 53.95 3ito s PHE 69 Cb -0.12 -3.10 -0.01 0.00 -0.57 0.00 0.00 43.02 39.21 3ito s PHE 69 CO -0.03 -0.76 1.27 -1.25 -0.10 0.00 0.00 175.22 174.34 3ito s PRO 70 N -0.60 2.56 0.00 0.24 0.04 -1.26 -4.95 135.00 131.02 3ito s PRO 70 Ca 0.21 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.23 3ito s PRO 70 Cb -0.16 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.52 3ito s PRO 70 CO -0.07 -1.57 0.00 0.41 0.04 0.00 0.00 177.00 175.81 3ito n GLY 71 N 0.76 1.91 3.87 0.56 0.00 -1.26 -5.10 105.19 105.94 3ito n GLY 71 Ca 0.15 -2.09 -0.30 0.00 0.00 0.00 0.00 46.02 43.78 3ito n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ito s THR 72 N 1.46 4.76 -1.42 2.61 -4.23 -1.26 -4.22 115.64 113.34 3ito s THR 72 Ca 0.00 0.67 -0.10 0.00 -1.18 0.00 0.00 61.69 61.08 3ito s THR 72 Cb 0.00 -3.77 0.04 0.00 1.34 0.00 0.00 72.50 70.11 3ito s THR 72 CO 0.00 -0.68 1.04 0.61 -0.54 0.00 0.00 174.62 175.05 3ito n GLY 73 N -1.68 -0.49 3.72 3.99 0.00 -1.26 -4.78 105.19 104.69 3ito n GLY 73 Ca 0.03 0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 3ito n GLY 73 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ito s GLU 74 N -6.36 4.24 0.16 1.61 0.41 -1.26 -4.72 118.70 112.78 3ito s GLU 74 Ca 0.53 2.31 -0.30 0.00 -0.41 0.00 0.00 54.97 57.10 3ito s GLU 74 Cb -0.25 -3.16 -0.07 0.00 -1.78 0.00 0.00 34.13 28.86 3ito s GLU 74 CO 0.78 -0.55 1.17 -1.25 -0.49 0.00 0.00 175.26 174.93 3ito s PRO 75 N 0.88 4.51 -0.21 0.39 0.04 -1.26 -4.95 135.00 134.40 3ito s PRO 75 Ca 0.67 1.82 0.01 0.00 0.04 0.00 0.00 61.00 63.55 3ito s PRO 75 Cb -0.42 -3.27 0.04 0.00 0.04 0.00 0.00 34.50 30.89 3ito s PRO 75 CO 0.33 -0.08 -0.13 1.03 0.04 0.00 0.00 177.00 178.19 3ito s ARG 76 N -0.04 2.37 0.00 4.56 1.81 -1.26 -4.84 118.95 121.55 3ito s ARG 76 Ca 0.53 -0.98 0.00 0.00 -1.72 0.00 0.00 55.73 53.56 3ito s ARG 76 Cb -0.31 -2.59 0.00 0.00 -0.45 0.00 0.00 34.95 31.60 3ito s ARG 76 CO 0.35 -0.40 0.00 0.41 -0.68 0.00 0.00 175.30 174.98 3ito n GLY 77 N 4.60 0.78 0.26 -3.53 0.00 -1.26 -4.29 105.19 101.74 3ito n GLY 77 Ca -0.16 -1.74 0.10 0.00 0.00 0.00 0.00 46.02 44.21 3ito n GLY 77 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3ito h ILE 78 N 0.00 0.85 -0.27 -0.61 6.09 -1.89 -2.43 117.51 119.25 3ito h ILE 78 Ca 0.00 -0.27 -0.12 0.00 -1.37 0.00 0.00 64.86 63.09 3ito h ILE 78 Cb 0.00 1.16 -0.00 0.00 0.47 0.00 0.00 36.82 38.44 3ito h ILE 78 CO 0.00 0.07 -0.31 -0.26 -3.07 0.00 0.00 178.15 174.58 3ito h PHE 79 N 0.00 0.84 -0.57 2.19 0.04 -1.97 0.83 116.94 118.31 3ito h PHE 79 Ca -0.00 -0.26 -0.08 0.00 2.80 0.00 0.00 57.97 60.43 3ito h PHE 79 Cb 0.15 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.11 3ito h PHE 79 CO 0.00 1.01 0.05 -0.44 -0.60 0.00 0.00 178.31 178.33 3ito h ASP 80 N 0.43 0.95 -0.52 2.17 3.32 -1.69 -2.17 116.42 118.91 3ito h ASP 80 Ca 0.04 -0.28 -0.02 0.00 0.02 0.00 0.00 57.03 56.78 3ito h ASP 80 Cb 0.89 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 3ito h ASP 80 CO 0.08 1.00 0.23 0.11 -1.72 0.00 0.00 179.24 178.93 3ito h LYS 81 N 0.87 0.76 -0.71 3.56 1.57 -1.30 -2.03 116.57 119.30 3ito h LYS 81 Ca 0.17 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 3ito h LYS 81 Cb 0.48 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 3ito h LYS 81 CO 0.02 0.65 0.32 -0.07 -0.57 0.00 0.00 179.45 179.81 3ito h LEU 82 N 0.69 0.92 -0.98 2.94 3.38 -0.73 0.49 115.31 122.02 3ito h LEU 82 Ca 0.18 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.06 3ito h LEU 82 Cb 0.16 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.62 3ito h LEU 82 CO -0.02 0.79 0.65 0.44 0.09 0.00 0.00 178.44 180.39 3ito h ASP 83 N 1.00 1.10 0.33 -0.43 3.32 -0.82 -1.04 116.42 119.89 3ito h ASP 83 Ca 0.24 -0.02 -0.24 0.00 0.02 0.00 0.00 57.03 57.04 3ito h ASP 83 Cb 0.12 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.42 3ito h ASP 83 CO -0.03 0.77 -0.98 0.44 -1.72 0.00 0.00 179.24 177.72 3ito h ASP 84 N 1.29 0.56 -0.47 6.45 3.32 -0.70 -3.13 116.42 123.74 3ito h ASP 84 Ca 0.38 -0.46 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 3ito h ASP 84 Cb -0.07 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 3ito h ASP 84 CO -0.10 1.27 0.29 0.00 -1.72 0.00 0.00 179.24 178.98 3ito h ALA 86 N 1.66 1.76 -0.34 0.00 0.00 -1.14 -1.92 119.26 119.27 3ito h ALA 86 Ca 0.17 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3ito h ALA 86 Cb -0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3ito h ALA 86 CO -0.03 0.22 0.14 0.28 0.00 0.00 0.00 179.25 179.86 3ito h VAL 87 N 0.49 1.18 -0.73 0.00 2.07 -1.28 -0.13 116.25 117.85 3ito h VAL 87 Ca 0.14 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.11 3ito h VAL 87 Cb -0.02 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 3ito h VAL 87 CO -0.03 0.20 0.46 0.40 0.02 0.00 0.00 177.57 178.61 3ito h ILE 88 N 0.41 1.20 -0.31 4.57 2.04 -1.31 -1.74 117.51 122.37 3ito h ILE 88 Ca 0.11 -0.41 -0.08 0.00 1.00 0.00 0.00 64.86 65.48 3ito h ILE 88 Cb 0.17 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 3ito h ILE 88 CO -0.01 0.20 -0.12 -0.61 0.00 0.00 0.00 178.15 177.61 3ito h GLN 89 N 1.00 0.64 -0.70 2.37 5.75 -1.19 -1.02 115.11 121.96 3ito h GLN 89 Ca 0.27 -0.27 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 3ito h GLN 89 Cb -0.07 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.42 3ito h GLN 89 CO -0.05 0.85 0.39 0.37 -2.65 0.00 0.00 178.83 177.74 3ito h GLN 90 N 0.40 0.97 0.08 1.69 4.15 -0.81 0.44 115.11 122.02 3ito h GLN 90 Ca 0.07 -0.11 -0.26 0.00 0.77 0.00 0.00 58.65 59.13 3ito h GLN 90 Cb 0.64 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.12 3ito h GLN 90 CO 0.04 0.71 -1.25 -0.07 -1.93 0.00 0.00 178.83 176.33 3ito h LEU 91 N 0.96 0.25 0.00 -2.39 3.38 -1.31 -3.35 115.31 112.85 3ito h LEU 91 Ca 0.25 -0.29 -0.19 0.00 0.09 0.00 0.00 57.88 57.73 3ito h LEU 91 Cb 0.02 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 3ito h LEU 91 CO -0.04 1.23 -2.06 0.35 0.09 0.00 0.00 178.44 178.01 3ito n THR 92 N -3.43 0.73 -1.61 0.22 -2.24 -0.39 -1.38 114.28 106.18 3ito n THR 92 Ca -0.08 -0.62 -0.21 0.00 -2.27 0.00 0.00 64.05 60.88 3ito n THR 92 Cb 1.00 -0.30 -0.09 0.00 -2.10 0.00 0.00 70.33 68.84 3ito n THR 92 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3ito n ARG 93 N -2.45 -1.46 0.00 -0.78 5.12 0.15 -4.80 116.66 112.45 3ito n ARG 93 Ca -0.19 1.22 0.04 0.00 -1.93 0.00 0.00 57.85 57.00 3ito n ARG 93 Cb 0.84 -5.61 0.02 0.00 -1.16 0.00 0.00 32.46 26.55 3ito n ARG 93 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3ito n ALA 94 N 1.33 2.54 -3.14 7.54 0.00 -1.26 -4.77 120.51 122.74 3ito n ALA 94 Ca -0.21 -0.52 -0.22 0.00 0.00 0.00 0.00 53.44 52.49 3ito n ALA 94 Cb 0.68 -0.27 -0.04 0.00 0.00 0.00 0.00 19.45 19.82 3ito n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3ito n THR 95 N 0.26 0.81 0.28 0.00 -2.24 -1.26 -1.29 114.28 110.83 3ito n THR 95 Ca 0.04 -4.81 0.16 0.00 -2.27 0.00 0.00 64.05 57.17 3ito n THR 95 Cb 0.19 -0.99 0.73 0.00 -2.10 0.00 0.00 70.33 68.16 3ito n THR 95 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3ito h PRO 96 N 3.26 0.00 -6.58 -0.78 0.13 -1.86 -3.40 132.00 122.77 3ito h PRO 96 Ca 0.11 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.56 3ito h PRO 96 Cb 0.81 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 31.72 3ito h PRO 96 CO 0.61 0.05 -0.80 -0.80 -0.23 0.00 0.00 178.00 176.83 3ito s ASN 97 N -5.76 3.84 0.02 1.44 0.01 -1.26 -0.26 114.94 112.96 3ito s ASN 97 Ca -0.00 -0.43 0.05 0.00 -0.71 0.00 0.00 52.86 51.76 3ito s ASN 97 Cb 0.10 -0.62 -0.03 0.00 0.41 0.00 0.00 41.25 41.11 3ito s ASN 97 CO 0.55 0.25 -0.11 -0.69 -1.51 0.00 0.00 177.10 175.59 3ito s VAL 98 N -0.95 3.34 -0.20 1.60 1.01 -0.24 -1.56 120.40 123.39 3ito s VAL 98 Ca 0.15 -0.92 -0.08 0.00 0.00 0.00 0.00 61.98 61.13 3ito s VAL 98 Cb -0.11 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.80 3ito s VAL 98 CO 0.06 0.38 0.09 -0.55 0.00 0.00 0.00 175.10 175.07 3ito s SER 99 N -1.41 5.69 0.14 3.32 0.15 -0.17 -0.15 113.70 121.27 3ito s SER 99 Ca 0.16 0.06 -0.01 0.00 0.70 0.00 0.00 55.95 56.86 3ito s SER 99 Cb -0.11 -1.99 -0.04 0.00 -1.71 0.00 0.00 66.02 62.16 3ito s SER 99 CO 0.07 0.13 0.32 -0.76 1.20 0.00 0.00 173.24 174.19 3ito s LEU 100 N 0.67 4.29 -0.11 3.45 1.43 -1.24 -1.31 118.68 125.87 3ito s LEU 100 Ca 0.04 0.38 0.02 0.00 -1.03 0.00 0.00 54.13 53.54 3ito s LEU 100 Cb -0.13 -3.11 0.01 0.00 0.03 0.00 0.00 46.19 42.99 3ito s LEU 100 CO 0.01 0.06 -0.17 -2.28 0.23 0.00 0.00 176.35 174.20 3ito s HIS 101 N -1.69 2.12 -0.04 0.29 2.46 -1.26 -0.70 115.29 116.47 3ito s HIS 101 Ca 0.38 -0.98 0.00 0.00 0.47 0.00 0.00 55.06 54.93 3ito s HIS 101 Cb -0.12 -1.50 -0.03 0.00 -0.13 0.00 0.00 32.58 30.80 3ito s HIS 101 CO 0.28 -0.48 -0.01 0.42 -2.47 0.00 0.00 174.74 172.47 3ito s ILE 102 N 0.86 4.11 -2.08 0.89 -1.09 -0.36 -0.34 121.20 123.19 3ito s ILE 102 Ca -0.09 -0.48 0.15 0.00 -2.23 0.00 0.00 60.65 58.00 3ito s ILE 102 Cb -0.15 -2.77 0.38 0.00 -1.58 0.00 0.00 42.46 38.33 3ito s ILE 102 CO -0.00 0.48 1.47 -0.81 -1.23 0.00 0.00 174.94 174.85 3ito n PRO 103 N 1.76 1.34 -0.22 2.79 -0.04 -1.26 -2.66 135.00 136.70 3ito n PRO 103 Ca -0.16 -0.51 0.00 0.00 -0.04 0.00 0.00 63.50 62.79 3ito n PRO 103 Cb 0.53 -1.27 0.12 0.00 -0.04 0.00 0.00 33.50 32.84 3ito n PRO 103 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3ito h TRP 104 N 0.96 0.52 -0.88 0.54 6.55 -1.86 -2.70 115.95 119.08 3ito h TRP 104 Ca 0.00 0.03 -0.39 0.00 0.95 0.00 0.00 58.89 59.48 3ito h TRP 104 Cb 0.21 -0.14 -0.23 0.00 -0.86 0.00 0.00 29.16 28.14 3ito h TRP 104 CO 0.06 0.18 0.49 -0.25 -1.05 0.00 0.00 178.44 177.87 3ito n ASP 105 N -4.92 4.14 -4.74 -3.49 8.00 0.54 -4.66 116.55 111.42 3ito n ASP 105 Ca 0.09 -3.47 -0.42 0.00 0.71 0.00 0.00 54.79 51.71 3ito n ASP 105 Cb 0.26 -0.80 -0.02 0.00 -0.02 0.00 0.00 41.12 40.54 3ito n ASP 105 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3ito s LYS 106 N -3.18 4.17 -0.00 -1.24 2.20 -1.02 -4.85 119.74 115.81 3ito s LYS 106 Ca 0.56 2.49 -0.29 0.00 -0.36 0.00 0.00 55.97 58.36 3ito s LYS 106 Cb 0.46 -3.08 0.10 0.00 -1.51 0.00 0.00 37.83 33.81 3ito s LYS 106 CO 0.12 -0.61 1.05 0.00 -0.36 0.00 0.00 175.35 175.54 3ito s ALA 107 N 0.48 -1.91 0.01 3.13 0.00 -1.26 -4.92 121.76 117.29 3ito s ALA 107 Ca 0.66 0.84 -0.31 0.00 0.00 0.00 0.00 51.96 53.15 3ito s ALA 107 Cb -0.46 0.35 -0.10 0.00 0.00 0.00 0.00 23.12 22.91 3ito s ALA 107 CO 0.40 -0.83 1.95 -3.47 0.00 0.00 0.00 175.76 173.81 3ito n ASP 108 N -0.32 3.99 -0.23 0.00 2.03 -1.26 -4.86 116.55 115.90 3ito n ASP 108 Ca -0.06 0.92 0.03 0.00 0.52 0.00 0.00 54.79 56.20 3ito n ASP 108 Cb 0.61 -1.49 0.12 0.00 -0.72 0.00 0.00 41.12 39.64 3ito n ASP 108 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3ito h PRO 109 N 10.16 0.09 -0.98 -0.67 0.11 -1.96 -0.09 132.00 138.66 3ito h PRO 109 Ca -0.49 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.66 3ito h PRO 109 Cb 1.25 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 32.27 3ito h PRO 109 CO 0.94 0.06 0.63 0.87 -0.21 0.00 0.00 178.00 180.30 3ito h LYS 110 N 0.09 1.15 -0.40 1.05 1.57 -1.89 0.12 116.57 118.26 3ito h LYS 110 Ca 0.37 -0.07 -0.12 0.00 -1.87 0.00 0.00 60.65 58.96 3ito h LYS 110 Cb 0.61 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3ito h LYS 110 CO -0.62 0.76 -0.22 0.93 -0.57 0.00 0.00 179.45 179.73 3ito h GLU 111 N 1.19 0.81 0.23 3.15 5.08 -1.45 -0.23 114.58 123.36 3ito h GLU 111 Ca 0.41 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3ito h GLU 111 Cb 0.09 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3ito h GLU 111 CO -0.15 0.96 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.63 3ito h LEU 112 N 0.71 -0.27 -0.86 1.33 3.38 -0.30 -0.84 115.31 118.46 3ito h LEU 112 Ca 0.10 -0.16 0.10 0.00 0.09 0.00 0.00 57.88 58.00 3ito h LEU 112 Cb 0.75 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.49 3ito h LEU 112 CO 0.06 0.02 0.51 0.50 0.09 0.00 0.00 178.44 179.62 3ito h LYS 113 N -0.56 0.83 -0.56 1.13 1.63 -0.74 -0.08 116.57 118.22 3ito h LYS 113 Ca -0.03 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.69 3ito h LYS 113 Cb 0.41 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 3ito h LYS 113 CO 0.05 0.55 0.24 0.00 -3.45 0.00 0.00 179.45 176.84 3ito h ALA 114 N 1.46 0.73 -0.37 5.00 0.00 -0.88 -1.37 119.26 123.84 3ito h ALA 114 Ca 0.41 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 3ito h ALA 114 Cb 0.36 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3ito h ALA 114 CO -0.24 0.33 -0.19 -0.09 0.00 0.00 0.00 179.25 179.05 3ito h ARG 115 N 0.76 0.70 -0.01 0.00 9.65 -0.13 -2.18 114.38 123.17 3ito h ARG 115 Ca 0.19 -0.26 -0.00 0.00 -1.10 0.00 0.00 59.98 58.81 3ito h ARG 115 Cb 0.18 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.71 3ito h ARG 115 CO -0.02 0.85 0.00 0.78 2.80 0.00 0.00 179.97 184.38 3ito h GLY 116 N 0.98 0.01 0.75 2.80 0.00 -0.74 -1.81 103.07 105.06 3ito h GLY 116 Ca 0.09 -0.01 0.06 0.00 0.00 0.00 0.00 47.33 47.48 3ito h GLY 116 CO 0.05 0.01 0.60 -0.55 0.00 0.00 0.00 176.54 176.64 3ito h ASP 117 N -0.16 0.96 -0.25 0.19 3.32 -1.15 0.81 116.42 120.13 3ito h ASP 117 Ca 0.00 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.99 3ito h ASP 117 Cb 0.17 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 3ito h ASP 117 CO -0.00 0.62 -0.08 0.00 -1.72 0.00 0.00 179.24 178.06 3ito h ALA 118 N 1.43 1.17 -0.00 3.45 0.00 -1.23 -2.87 119.26 121.20 3ito h ALA 118 Ca 0.40 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3ito h ALA 118 Cb 0.15 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3ito h ALA 118 CO -0.17 0.53 -0.37 1.28 0.00 0.00 0.00 179.25 180.53 3ito n LEU 119 N -4.20 0.40 -0.12 0.00 4.77 -0.69 -4.94 117.00 112.21 3ito n LEU 119 Ca 0.01 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 3ito n LEU 119 Cb 0.32 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3ito n LEU 119 CO 0.41 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 3ito n GLY 120 N 1.49 0.56 3.29 -0.72 0.00 -0.13 -4.92 105.19 104.76 3ito n GLY 120 Ca 0.06 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 44.98 3ito n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ito s LEU 121 N -0.24 2.09 0.00 0.99 1.43 0.09 -4.90 118.68 118.14 3ito s LEU 121 Ca 0.00 -0.48 0.05 0.00 -1.03 0.00 0.00 54.13 52.67 3ito s LEU 121 Cb 0.00 -1.22 0.05 0.00 0.03 0.00 0.00 46.19 45.05 3ito s LEU 121 CO 0.00 0.27 0.39 0.61 0.23 0.00 0.00 176.35 177.86 3ito n GLY 122 N 2.25 2.55 3.12 -3.19 0.00 0.64 -3.89 105.19 106.67 3ito n GLY 122 Ca -0.16 -2.25 -0.29 0.00 0.00 0.00 0.00 46.02 43.32 3ito n GLY 122 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ito s PHE 123 N -1.92 2.14 0.00 1.61 0.08 -1.26 -1.08 117.98 117.55 3ito s PHE 123 Ca 0.30 -0.93 0.00 0.00 0.12 0.00 0.00 56.93 56.42 3ito s PHE 123 Cb -0.02 -1.49 0.00 0.00 -0.57 0.00 0.00 43.02 40.94 3ito s PHE 123 CO 0.19 -0.43 0.00 -3.47 -0.10 0.00 0.00 175.22 171.41 3ito n ASP 124 N 3.86 0.00 -4.69 1.36 2.03 0.79 -4.07 116.55 115.84 3ito n ASP 124 Ca -0.20 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.70 3ito n ASP 124 Cb 0.52 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.93 3ito n ASP 124 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3ito n ALA 125 N -3.00 1.13 -1.91 -1.67 0.00 -1.26 -4.53 120.51 109.27 3ito n ALA 125 Ca 0.00 0.25 -0.33 0.00 0.00 0.00 0.00 53.44 53.36 3ito n ALA 125 Cb 0.00 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.14 3ito n ALA 125 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3ito s MET 126 N -2.21 4.18 -0.17 0.00 -1.94 0.52 -3.65 119.30 116.04 3ito s MET 126 Ca 0.62 1.00 0.01 0.00 -1.71 0.00 0.00 55.69 55.60 3ito s MET 126 Cb -0.51 -2.29 0.03 0.00 2.01 0.00 0.00 34.83 34.06 3ito s MET 126 CO 0.57 0.05 -0.15 -0.80 -0.01 0.00 0.00 175.02 174.68 3ito s ASN 127 N -2.17 2.97 0.63 3.03 0.01 0.12 -0.10 114.94 119.44 3ito s ASN 127 Ca 0.59 -0.62 -0.10 0.00 -0.71 0.00 0.00 52.86 52.02 3ito s ASN 127 Cb -0.10 -1.28 -0.02 0.00 0.41 0.00 0.00 41.25 40.27 3ito s ASN 127 CO 0.15 -0.06 1.01 -0.94 -1.51 0.00 0.00 177.10 175.75 3ito s SER 128 N 1.41 5.89 -0.34 -1.22 1.04 -1.16 -1.22 113.70 118.10 3ito s SER 128 Ca 0.04 1.19 -0.01 0.00 0.48 0.00 0.00 55.95 57.64 3ito s SER 128 Cb -0.14 -2.17 0.12 0.00 0.10 0.00 0.00 66.02 63.93 3ito s SER 128 CO -0.11 -1.03 0.18 0.21 0.98 0.00 0.00 173.24 173.47 3ito s ASN 129 N -4.25 3.38 -0.23 7.02 3.84 -1.09 -4.72 114.94 118.89 3ito s ASN 129 Ca 0.55 -1.92 0.12 0.00 0.21 0.00 0.00 52.86 51.82 3ito s ASN 129 Cb -0.11 -0.55 0.45 0.00 -0.55 0.00 0.00 41.25 40.50 3ito s ASN 129 CO 0.51 -0.35 1.19 0.35 -2.79 0.00 0.00 177.10 176.00 3ito n THR 130 N 4.42 2.03 -0.25 -5.21 -2.24 -1.26 -4.59 114.28 107.18 3ito n THR 130 Ca 0.04 -3.44 0.04 0.00 -2.27 0.00 0.00 64.05 58.42 3ito n THR 130 Cb 0.39 -0.33 0.09 0.00 -2.10 0.00 0.00 70.33 68.37 3ito n THR 130 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 3ito n PHE 131 N -0.72 0.23 -3.52 4.78 1.16 -1.26 -4.58 117.46 113.55 3ito n PHE 131 Ca 0.28 -0.58 -0.14 0.00 -1.87 0.00 0.00 57.45 55.14 3ito n PHE 131 Cb 0.87 -0.07 -0.04 0.00 -1.61 0.00 0.00 39.48 38.63 3ito n PHE 131 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 3ito s SER 132 N -1.27 -0.50 -0.14 5.98 1.04 -1.26 -4.93 113.70 112.62 3ito s SER 132 Ca 0.14 0.18 -0.11 0.00 0.48 0.00 0.00 55.95 56.64 3ito s SER 132 Cb 0.10 0.53 -0.05 0.00 0.10 0.00 0.00 66.02 66.70 3ito s SER 132 CO 0.06 -0.79 0.22 -1.81 0.98 0.00 0.00 173.24 171.90 3ito s ASP 133 N -2.15 6.41 0.18 7.02 1.01 -1.26 -4.84 116.67 123.04 3ito s ASP 133 Ca -0.04 0.48 -0.04 0.00 0.71 0.00 0.00 52.55 53.66 3ito s ASP 133 Cb -0.00 -2.13 -0.05 0.00 1.01 0.00 0.00 42.92 41.74 3ito s ASP 133 CO -0.04 0.24 0.41 0.00 0.21 0.00 0.00 175.17 175.99 3ito s ALA 134 N -0.18 3.77 0.43 5.23 0.00 -1.26 -5.04 121.76 124.71 3ito s ALA 134 Ca 0.15 -0.60 -0.25 0.00 0.00 0.00 0.00 51.96 51.26 3ito s ALA 134 Cb -0.13 -2.14 -0.09 0.00 0.00 0.00 0.00 23.12 20.76 3ito s ALA 134 CO 0.04 0.57 1.27 -2.30 0.00 0.00 0.00 175.76 175.33 3ito n PRO 135 N -0.20 1.88 -0.48 0.00 -0.02 -1.26 -2.11 135.00 132.81 3ito n PRO 135 Ca -0.03 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 3ito n PRO 135 Cb 0.52 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 3ito n PRO 135 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ito n GLY 136 N 0.82 1.83 3.70 -1.23 0.00 -1.26 -4.98 105.19 104.07 3ito n GLY 136 Ca 0.07 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 3ito n GLY 136 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3ito n GLN 137 N -2.00 2.40 -0.11 1.61 7.27 -0.90 -4.91 117.38 120.74 3ito n GLN 137 Ca 0.00 0.86 -0.10 0.00 0.07 0.00 0.00 57.00 57.83 3ito n GLN 137 Cb 0.00 -2.64 0.04 0.00 2.41 0.00 0.00 30.24 30.05 3ito n GLN 137 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3ito h ALA 138 N 5.72 0.74 -3.95 1.69 0.00 -1.93 -3.44 119.26 118.09 3ito h ALA 138 Ca -0.45 -0.41 -0.55 0.00 0.00 0.00 0.00 54.91 53.51 3ito h ALA 138 Cb 1.24 -0.15 -0.31 0.00 0.00 0.00 0.00 17.79 18.57 3ito h ALA 138 CO 0.87 0.66 -0.83 -1.01 0.00 0.00 0.00 179.25 178.94 3ito s HIS 139 N -4.54 1.64 0.35 0.00 3.76 -1.26 -5.13 115.29 110.12 3ito s HIS 139 Ca -0.10 -0.45 -0.22 0.00 -0.15 0.00 0.00 55.06 54.14 3ito s HIS 139 Cb 0.12 -1.10 -0.10 0.00 1.11 0.00 0.00 32.58 32.61 3ito s HIS 139 CO 0.86 -0.14 0.90 0.45 -0.85 0.00 0.00 174.74 175.95 3ito s SER 140 N -0.01 7.09 -0.09 1.40 0.15 -1.26 -4.97 113.70 116.01 3ito s SER 140 Ca -0.02 1.67 0.16 0.00 0.70 0.00 0.00 55.95 58.46 3ito s SER 140 Cb -0.11 -2.52 0.63 0.00 -1.71 0.00 0.00 66.02 62.31 3ito s SER 140 CO 0.02 -0.19 1.52 -1.22 1.20 0.00 0.00 173.24 174.57 3ito n TYR 141 N -0.01 1.28 -0.25 3.44 4.01 -1.26 -4.56 117.16 119.82 3ito n TYR 141 Ca 0.04 -0.52 0.05 0.00 -0.16 0.00 0.00 57.90 57.31 3ito n TYR 141 Cb 0.52 -0.21 0.17 0.00 -0.31 0.00 0.00 39.34 39.51 3ito n TYR 141 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3ito h LYS 142 N 3.60 0.17 -0.52 -0.72 3.64 -1.95 -1.30 116.57 119.51 3ito h LYS 142 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3ito h LYS 142 Cb 1.27 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 3ito h LYS 142 CO 0.19 0.11 0.00 0.66 -2.27 0.00 0.00 179.45 178.15 3ito n TYR 143 N -5.25 1.66 0.00 1.91 4.01 -1.26 -5.05 117.16 113.18 3ito n TYR 143 Ca 0.14 -0.73 0.00 0.00 -0.16 0.00 0.00 57.90 57.14 3ito n TYR 143 Cb 0.46 -0.40 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 3ito n TYR 143 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ito n GLY 144 N 0.48 1.61 0.00 2.72 0.00 -0.49 -4.68 105.19 104.82 3ito n GLY 144 Ca 0.26 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 44.22 3ito n GLY 144 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ito n SER 145 N 0.00 0.00 0.30 1.61 3.41 -1.26 -4.24 113.62 113.44 3ito n SER 145 Ca 0.00 0.00 0.20 0.00 -0.26 0.00 0.00 58.87 58.81 3ito n SER 145 Cb 0.00 0.00 0.92 0.00 -0.26 0.00 0.00 64.21 64.87 3ito n SER 145 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3ito h LEU 146 N 0.00 0.00 -2.99 1.04 3.38 -1.87 -2.46 115.31 112.41 3ito h LEU 146 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ito h LEU 146 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3ito h LEU 146 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.99 3ito n SER 147 N -3.10 2.57 -4.74 -0.43 3.41 -1.26 -3.84 113.62 106.23 3ito n SER 147 Ca -0.01 -2.26 -0.39 0.00 -0.26 0.00 0.00 58.87 55.95 3ito n SER 147 Cb 0.21 -0.20 0.04 0.00 -0.26 0.00 0.00 64.21 64.00 3ito n SER 147 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3ito n HIS 148 N -0.29 2.26 0.25 7.33 -0.00 -0.93 -4.80 115.22 119.05 3ito n HIS 148 Ca 0.08 0.43 0.13 0.00 -0.00 0.00 0.00 57.72 58.37 3ito n HIS 148 Cb 0.43 -2.36 0.66 0.00 -0.00 0.00 0.00 29.99 28.72 3ito n HIS 148 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 3ito h THR 149 N 1.46 0.48 -3.31 3.57 1.35 -1.91 -3.43 112.91 111.12 3ito h THR 149 Ca -0.51 -0.70 -0.59 0.00 -0.55 0.00 0.00 66.41 64.06 3ito h THR 149 Cb 1.30 1.48 -0.08 0.00 -1.73 0.00 0.00 68.15 69.13 3ito h THR 149 CO 0.57 0.14 0.39 0.21 -0.25 0.00 0.00 175.52 176.57 3ito s ASN 150 N -6.07 6.88 0.17 5.36 2.47 -1.26 -4.97 114.94 117.53 3ito s ASN 150 Ca -0.01 1.09 -0.14 0.00 0.42 0.00 0.00 52.86 54.21 3ito s ASN 150 Cb 0.12 -2.44 0.14 0.00 -1.45 0.00 0.00 41.25 37.62 3ito s ASN 150 CO 0.59 -0.42 1.74 0.00 -3.72 0.00 0.00 177.10 175.29 3ito h ALA 151 N 7.47 0.53 -0.71 1.71 0.00 -2.00 -2.11 119.26 124.15 3ito h ALA 151 Ca -0.27 0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.75 3ito h ALA 151 Cb 1.12 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 3ito h ALA 151 CO 0.84 -0.26 0.47 0.00 0.00 0.00 0.00 179.25 180.31 3ito h ALA 152 N 1.31 1.63 -0.48 0.00 0.00 -1.96 -0.75 119.26 119.01 3ito h ALA 152 Ca 0.22 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 3ito h ALA 152 Cb 0.23 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3ito h ALA 152 CO -0.24 0.29 -0.12 1.15 0.00 0.00 0.00 179.25 180.33 3ito h THR 153 N 0.82 1.27 -0.48 0.00 2.02 -1.75 -0.97 112.91 113.83 3ito h THR 153 Ca 0.29 -1.26 -0.05 0.00 0.77 0.00 0.00 66.41 66.16 3ito h THR 153 Cb 0.12 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 3ito h THR 153 CO -0.09 0.43 0.09 0.03 0.37 0.00 0.00 175.52 176.36 3ito h ARG 154 N 0.78 0.79 -0.72 6.66 3.08 -0.98 -1.79 114.38 122.19 3ito h ARG 154 Ca 0.12 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 3ito h ARG 154 Cb 0.68 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 3ito h ARG 154 CO 0.05 0.78 0.40 0.00 -1.07 0.00 0.00 179.97 180.13 3ito h ALA 155 N 0.97 1.36 -0.53 0.04 0.00 -0.96 0.91 119.26 121.04 3ito h ALA 155 Ca 0.15 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3ito h ALA 155 Cb 0.36 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3ito h ALA 155 CO 0.01 0.53 -0.02 0.37 0.00 0.00 0.00 179.25 180.14 3ito h GLN 156 N 1.00 0.95 -0.44 0.00 4.15 -0.88 -0.50 115.11 119.39 3ito h GLN 156 Ca 0.26 -0.31 -0.11 0.00 0.77 0.00 0.00 58.65 59.25 3ito h GLN 156 Cb 0.01 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 27.60 3ito h GLN 156 CO -0.04 0.98 -0.17 0.00 -1.93 0.00 0.00 178.83 177.66 3ito h ALA 157 N 0.94 0.87 -0.11 3.38 0.00 -0.67 -1.21 119.26 122.47 3ito h ALA 157 Ca 0.15 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3ito h ALA 157 Cb 0.56 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3ito h ALA 157 CO 0.03 0.64 0.03 0.28 0.00 0.00 0.00 179.25 180.23 3ito h VAL 158 N 0.74 1.18 -0.79 0.00 2.07 -0.60 -1.96 116.25 116.90 3ito h VAL 158 Ca 0.11 -0.55 0.04 0.00 0.82 0.00 0.00 66.70 67.13 3ito h VAL 158 Cb 0.69 1.34 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 3ito h VAL 158 CO 0.05 0.16 0.49 -0.08 0.02 0.00 0.00 177.57 178.21 3ito h GLU 159 N -0.02 0.90 -0.53 1.57 4.57 -0.95 -0.73 114.58 119.39 3ito h GLU 159 Ca 0.03 -0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.20 3ito h GLU 159 Cb 0.22 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.57 3ito h GLU 159 CO -0.00 0.59 0.28 1.25 -1.18 0.00 0.00 179.01 179.95 3ito h HIS 160 N 0.93 0.51 -0.37 0.92 2.76 -1.02 -0.03 115.15 118.85 3ito h HIS 160 Ca 0.33 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.46 3ito h HIS 160 Cb 0.09 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 28.88 3ito h HIS 160 CO -0.04 0.26 -0.01 -0.91 -1.30 0.00 0.00 177.93 175.93 3ito h ASN 161 N 0.54 0.56 -0.27 3.26 2.35 -0.55 -1.61 115.58 119.86 3ito h ASN 161 Ca 0.23 -0.12 -0.11 0.00 -0.55 0.00 0.00 56.30 55.75 3ito h ASN 161 Cb 0.12 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 3ito h ASN 161 CO -0.15 0.64 -0.22 -0.07 -1.65 0.00 0.00 177.43 175.98 3ito h LEU 162 N 0.56 0.76 -1.23 1.61 3.38 -0.33 -2.28 115.31 117.77 3ito h LEU 162 Ca 0.12 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 3ito h LEU 162 Cb 0.38 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 3ito h LEU 162 CO 0.01 0.96 -0.11 -0.08 0.09 0.00 0.00 178.44 179.32 3ito h GLU 163 N 0.65 0.40 -0.26 1.13 4.81 -0.45 -1.44 114.58 119.41 3ito h GLU 163 Ca 0.09 -0.10 -0.08 0.00 -0.13 0.00 0.00 59.36 59.14 3ito h GLU 163 Cb 0.73 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 3ito h GLU 163 CO 0.06 0.51 -0.17 0.00 -0.73 0.00 0.00 179.01 178.68 3ito h ILE 165 N 0.41 1.28 -0.63 0.00 2.04 -0.84 -1.56 117.51 118.21 3ito h ILE 165 Ca 0.07 -1.55 -0.00 0.00 1.00 0.00 0.00 64.86 64.38 3ito h ILE 165 Cb 0.54 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 3ito h ILE 165 CO 0.04 0.51 0.39 -0.33 0.00 0.00 0.00 178.15 178.75 3ito h GLU 166 N 0.65 0.85 -0.41 2.37 4.39 -0.85 0.12 114.58 121.70 3ito h GLU 166 Ca 0.05 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 3ito h GLU 166 Cb 0.97 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 29.42 3ito h GLU 166 CO 0.09 0.60 0.20 0.82 -1.16 0.00 0.00 179.01 179.57 3ito h ILE 167 N 0.85 1.17 -0.64 3.13 1.08 -1.17 -2.80 117.51 119.14 3ito h ILE 167 Ca 0.23 -0.48 -0.01 0.00 -0.39 0.00 0.00 64.86 64.21 3ito h ILE 167 Cb -0.04 0.73 -0.03 0.00 -3.07 0.00 0.00 36.82 34.41 3ito h ILE 167 CO -0.04 0.18 0.37 1.23 -0.69 0.00 0.00 178.15 179.19 3ito h GLY 168 N 0.53 0.95 2.00 5.37 0.00 -0.66 -2.19 103.07 109.07 3ito h GLY 168 Ca 0.14 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 3ito h GLY 168 CO -0.02 0.40 -0.02 0.50 0.00 0.00 0.00 176.54 177.41 3ito h LYS 169 N 0.88 0.00 0.00 4.80 1.57 -0.62 -1.07 116.57 122.13 3ito h LYS 169 Ca 0.23 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.99 3ito h LYS 169 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3ito h LYS 169 CO -0.04 0.02 -0.10 0.00 -0.57 0.00 0.00 179.45 178.76 3ito h ALA 170 N 1.98 0.94 -0.01 3.86 0.00 -1.14 -3.35 119.26 121.55 3ito h ALA 170 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3ito h ALA 170 Cb 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3ito h ALA 170 CO 0.00 0.12 -0.01 0.44 0.00 0.00 0.00 179.25 179.81 3ito n ILE 171 N -3.13 0.00 0.00 0.00 -5.35 -0.79 -4.84 119.36 105.25 3ito n ILE 171 Ca 0.03 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 62.02 3ito n ILE 171 Cb 0.56 1.18 0.00 0.00 -1.74 0.00 0.00 39.64 39.64 3ito n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ito n GLY 172 N 0.52 0.76 3.78 3.28 0.00 -0.81 -4.59 105.19 108.12 3ito n GLY 172 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 3ito n GLY 172 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ito s SER 173 N -2.04 5.28 -0.03 1.61 0.15 -0.47 -4.80 113.70 113.39 3ito s SER 173 Ca 0.00 1.98 0.05 0.00 0.70 0.00 0.00 55.95 58.67 3ito s SER 173 Cb 0.00 -2.55 0.07 0.00 -1.71 0.00 0.00 66.02 61.83 3ito s SER 173 CO 0.00 -1.51 0.95 0.29 1.20 0.00 0.00 173.24 174.17 3ito n LYS 174 N -2.27 0.58 -3.50 5.44 4.76 -1.26 -4.47 118.16 117.45 3ito n LYS 174 Ca 0.10 -1.36 -0.13 0.00 -2.87 0.00 0.00 58.31 54.05 3ito n LYS 174 Cb 0.52 -0.80 -0.04 0.00 -1.84 0.00 0.00 35.03 32.87 3ito n LYS 174 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3ito s ALA 175 N -0.82 -1.76 -0.13 7.82 0.00 -1.26 -1.94 121.76 123.67 3ito s ALA 175 Ca 0.08 1.07 0.02 0.00 0.00 0.00 0.00 51.96 53.13 3ito s ALA 175 Cb 0.07 0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.42 3ito s ALA 175 CO 0.01 -0.53 -0.17 -1.17 0.00 0.00 0.00 175.76 173.89 3ito s LEU 176 N -1.87 1.86 -0.21 0.00 2.96 -0.63 -0.35 118.68 120.44 3ito s LEU 176 Ca -0.03 -0.50 -0.10 0.00 -0.22 0.00 0.00 54.13 53.28 3ito s LEU 176 Cb -0.01 -1.24 -0.05 0.00 0.50 0.00 0.00 46.19 45.40 3ito s LEU 176 CO -0.02 0.02 0.13 -0.89 -1.32 0.00 0.00 176.35 174.28 3ito s THR 177 N 1.02 5.33 -0.30 3.68 2.01 0.86 -0.62 115.64 127.62 3ito s THR 177 Ca -0.04 0.16 0.02 0.00 0.31 0.00 0.00 61.69 62.14 3ito s THR 177 Cb -0.15 -3.44 0.07 0.00 0.01 0.00 0.00 72.50 68.99 3ito s THR 177 CO -0.04 0.42 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.59 3ito s VAL 178 N 0.55 2.46 -0.12 3.82 1.01 0.16 -2.97 120.40 125.31 3ito s VAL 178 Ca 0.07 -1.77 0.03 0.00 0.00 0.00 0.00 61.98 60.31 3ito s VAL 178 Cb -0.12 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.73 3ito s VAL 178 CO -0.00 -0.22 -0.20 0.86 0.00 0.00 0.00 175.10 175.53 3ito s TRP 179 N 1.09 2.41 0.24 5.22 -0.00 -1.26 -2.04 118.94 124.60 3ito s TRP 179 Ca -0.02 -1.14 0.08 0.00 -0.00 0.00 0.00 56.10 55.02 3ito s TRP 179 Cb -0.20 -1.66 -0.05 0.00 -0.00 0.00 0.00 33.47 31.56 3ito s TRP 179 CO -0.05 -0.52 -0.13 0.96 -0.00 0.00 0.00 176.95 177.22 3ito s ILE 180 N 0.75 1.81 -0.96 5.86 -4.36 -1.26 -4.71 121.20 118.33 3ito s ILE 180 Ca -0.10 -2.21 0.25 0.00 -0.26 0.00 0.00 60.65 58.33 3ito s ILE 180 Cb -0.16 -2.20 -0.00 0.00 1.25 0.00 0.00 42.46 41.35 3ito s ILE 180 CO 0.01 -0.48 1.38 0.61 0.24 0.00 0.00 174.94 176.70 3ito n GLY 181 N -0.47 -1.25 2.33 6.27 0.00 -1.26 -4.96 105.19 105.83 3ito n GLY 181 Ca -0.07 -0.35 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 3ito n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ito n ASP 182 N -1.56 0.27 0.00 1.61 9.92 -1.26 -4.11 116.55 121.42 3ito n ASP 182 Ca 0.05 0.76 0.00 0.00 -0.53 0.00 0.00 54.79 55.07 3ito n ASP 182 Cb 0.35 -0.59 0.00 0.00 -0.64 0.00 0.00 41.12 40.24 3ito n ASP 182 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3ito n GLY 183 N 1.54 -0.58 3.13 0.44 0.00 -1.26 -1.93 105.19 106.53 3ito n GLY 183 Ca 0.15 -0.71 -0.08 0.00 0.00 0.00 0.00 46.02 45.38 3ito n GLY 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ito s SER 184 N -4.00 0.38 0.00 1.61 1.04 0.36 -4.89 113.70 108.20 3ito s SER 184 Ca 0.00 -0.91 0.10 0.00 0.48 0.00 0.00 55.95 55.62 3ito s SER 184 Cb 0.00 0.24 0.03 0.00 0.10 0.00 0.00 66.02 66.39 3ito s SER 184 CO 0.00 -0.64 0.71 0.59 0.98 0.00 0.00 173.24 174.88 3ito n ASN 185 N 0.05 1.47 -3.86 7.02 4.13 -1.26 -1.38 115.26 121.43 3ito n ASN 185 Ca -0.14 -1.23 -0.12 0.00 1.68 0.00 0.00 54.58 54.77 3ito n ASN 185 Cb 0.61 0.28 -0.13 0.00 -1.54 0.00 0.00 39.78 39.01 3ito n ASN 185 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3ito s PHE 186 N -1.16 -0.04 0.36 3.10 0.08 -1.26 -4.43 117.98 114.63 3ito s PHE 186 Ca 0.10 0.11 -0.28 0.00 0.12 0.00 0.00 56.93 56.97 3ito s PHE 186 Cb 0.08 0.01 -0.11 0.00 -0.57 0.00 0.00 43.02 42.43 3ito s PHE 186 CO 0.20 -0.03 1.52 -2.14 -0.10 0.00 0.00 175.22 174.67 3ito s PRO 187 N -0.04 4.10 0.00 0.24 0.02 -1.26 -1.72 135.00 136.34 3ito s PRO 187 Ca -0.01 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.61 3ito s PRO 187 Cb -0.01 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 31.54 3ito s PRO 187 CO 0.00 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.51 3ito n GLY 188 N 0.74 2.94 0.25 0.52 0.00 -1.26 -4.87 105.19 103.50 3ito n GLY 188 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.04 3ito n GLY 188 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3ito h GLN 189 N 0.76 0.53 -6.60 1.61 4.15 -1.77 -3.42 115.11 110.37 3ito h GLN 189 Ca 0.00 -0.03 -0.65 0.00 0.77 0.00 0.00 58.65 58.74 3ito h GLN 189 Cb 0.00 -0.12 -0.18 0.00 0.21 0.00 0.00 27.48 27.39 3ito h GLN 189 CO 0.00 0.35 -0.81 -1.12 -1.93 0.00 0.00 178.83 175.32 3ito s SER 190 N -5.48 3.52 -0.41 -0.69 0.01 -1.26 -5.09 113.70 104.30 3ito s SER 190 Ca -0.13 -0.84 -0.14 0.00 1.31 0.00 0.00 55.95 56.15 3ito s SER 190 Cb 0.17 -0.30 0.02 0.00 0.21 0.00 0.00 66.02 66.11 3ito s SER 190 CO 0.75 0.12 0.29 0.21 0.41 0.00 0.00 173.24 175.02 3ito s ASN 191 N -2.69 6.06 0.26 2.44 3.84 -1.26 -4.97 114.94 118.62 3ito s ASN 191 Ca 0.21 -0.92 -0.05 0.00 0.21 0.00 0.00 52.86 52.31 3ito s ASN 191 Cb -0.08 -2.14 0.50 0.00 -0.55 0.00 0.00 41.25 38.98 3ito s ASN 191 CO 0.10 -0.45 1.62 -0.26 -2.79 0.00 0.00 177.10 175.33 3ito h PHE 192 N 8.61 -0.06 -0.18 0.43 0.04 -1.98 -0.95 116.94 122.84 3ito h PHE 192 Ca -0.27 0.06 -0.12 0.00 2.80 0.00 0.00 57.97 60.45 3ito h PHE 192 Cb 1.12 0.16 0.00 0.00 2.20 0.00 0.00 35.95 39.43 3ito h PHE 192 CO 0.55 -0.28 -0.34 1.15 -0.60 0.00 0.00 178.31 178.79 3ito h THR 193 N 0.09 1.34 -0.46 -1.55 2.02 -1.99 -2.70 112.91 109.65 3ito h THR 193 Ca 0.45 -1.58 -0.11 0.00 0.77 0.00 0.00 66.41 65.95 3ito h THR 193 Cb 0.82 1.90 -0.02 0.00 -1.74 0.00 0.00 68.15 69.11 3ito h THR 193 CO -0.73 0.48 -0.15 0.03 0.37 0.00 0.00 175.52 175.53 3ito h ARG 194 N 0.21 0.88 -0.85 6.66 3.08 -1.89 -0.62 114.38 121.85 3ito h ARG 194 Ca 0.01 -0.32 -0.01 0.00 0.07 0.00 0.00 59.98 59.72 3ito h ARG 194 Cb 0.93 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.89 3ito h ARG 194 CO 0.08 0.96 0.49 0.00 -1.07 0.00 0.00 179.97 180.43 3ito h ALA 195 N 1.05 1.09 -0.19 0.04 0.00 -1.23 -0.88 119.26 119.15 3ito h ALA 195 Ca 0.12 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3ito h ALA 195 Cb 0.67 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3ito h ALA 195 CO 0.05 0.58 -0.56 0.35 0.00 0.00 0.00 179.25 179.67 3ito h PHE 196 N 1.18 0.71 -0.66 0.00 3.57 -1.22 -1.78 116.94 118.74 3ito h PHE 196 Ca 0.30 -0.25 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 3ito h PHE 196 Cb -0.00 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.58 3ito h PHE 196 CO 0.00 0.99 0.23 0.93 -2.23 0.00 0.00 178.31 178.24 3ito h GLU 197 N 0.43 1.01 -0.67 1.11 5.08 -0.68 -0.52 114.58 120.34 3ito h GLU 197 Ca 0.01 -0.20 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 3ito h GLU 197 Cb 1.10 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 3ito h GLU 197 CO 0.11 0.87 0.23 0.00 -1.00 0.00 0.00 179.01 179.21 3ito h ARG 198 N 0.95 1.02 0.05 2.33 3.08 -1.03 -1.85 114.38 118.94 3ito h ARG 198 Ca 0.22 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 3ito h ARG 198 Cb 0.26 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.15 3ito h ARG 198 CO -0.01 0.88 -0.03 -0.92 -1.07 0.00 0.00 179.97 178.82 3ito h TYR 199 N 0.96 -0.07 -0.94 3.04 5.03 -0.93 -1.67 116.97 122.39 3ito h TYR 199 Ca 0.22 -0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.57 3ito h TYR 199 Cb 0.27 0.02 -0.06 0.00 1.55 0.00 0.00 36.73 38.51 3ito h TYR 199 CO 0.02 0.04 0.61 -0.07 -1.32 0.00 0.00 178.16 177.44 3ito h LEU 200 N -0.16 1.00 -0.61 2.82 3.38 -0.99 0.70 115.31 121.45 3ito h LEU 200 Ca -0.01 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 3ito h LEU 200 Cb 0.14 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 3ito h LEU 200 CO 0.01 0.67 0.11 -1.28 0.09 0.00 0.00 178.44 178.03 3ito h SER 201 N 1.15 0.96 -0.38 -0.43 0.87 -1.18 -1.32 113.55 113.23 3ito h SER 201 Ca 0.39 -0.26 -0.16 0.00 -1.23 0.00 0.00 61.79 60.53 3ito h SER 201 Cb 0.06 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 3ito h SER 201 CO -0.14 0.97 -0.38 0.00 -0.53 0.00 0.00 176.83 176.75 3ito h ALA 202 N 1.02 0.55 0.00 6.23 0.00 -0.69 -2.90 119.26 123.47 3ito h ALA 202 Ca 0.19 -0.45 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 3ito h ALA 202 Cb 0.42 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3ito h ALA 202 CO 0.01 0.65 -0.30 0.52 0.00 0.00 0.00 179.25 180.13 3ito h MET 203 N 0.74 0.00 -0.36 0.00 2.07 -0.75 -1.86 114.93 114.76 3ito h MET 203 Ca 0.06 0.00 -0.07 0.00 -2.07 0.00 0.00 59.70 57.62 3ito h MET 203 Cb 0.97 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.69 3ito h MET 203 CO 0.09 0.30 -0.05 0.00 1.07 0.00 0.00 176.91 178.33 3ito h ALA 204 N 1.70 1.24 -0.43 6.32 0.00 -1.05 0.97 119.26 128.02 3ito h ALA 204 Ca -0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 3ito h ALA 204 Cb 0.55 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3ito h ALA 204 CO 0.04 0.50 -0.20 0.93 0.00 0.00 0.00 179.25 180.52 3ito h GLU 205 N 0.56 0.84 -0.34 0.00 5.08 -1.20 -2.10 114.58 117.41 3ito h GLU 205 Ca 0.11 -0.33 -0.12 0.00 -1.00 0.00 0.00 59.36 58.02 3ito h GLU 205 Cb 0.43 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 3ito h GLU 205 CO 0.02 0.96 -0.24 0.82 -1.00 0.00 0.00 179.01 179.57 3ito h ILE 206 N 0.73 1.29 -0.85 3.13 2.04 -1.05 -2.97 117.51 119.83 3ito h ILE 206 Ca 0.10 -1.39 0.09 0.00 1.00 0.00 0.00 64.86 64.66 3ito h ILE 206 Cb 0.72 1.44 -0.06 0.00 -0.74 0.00 0.00 36.82 38.19 3ito h ILE 206 CO 0.06 0.46 0.55 0.22 0.00 0.00 0.00 178.15 179.43 3ito h TYR 207 N 0.54 0.90 0.00 1.37 5.03 -0.63 -0.52 116.97 123.67 3ito h TYR 207 Ca 0.07 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.39 3ito h TYR 207 Cb 0.81 -0.29 -0.00 0.00 1.55 0.00 0.00 36.73 38.79 3ito h TYR 207 CO 0.06 0.44 -0.05 0.87 -1.32 0.00 0.00 178.16 178.16 3ito h LYS 208 N 0.85 0.00 -0.27 1.82 1.57 -1.22 -2.34 116.57 116.99 3ito h LYS 208 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 3ito h LYS 208 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 3ito h LYS 208 CO -0.15 0.05 0.00 0.41 -0.57 0.00 0.00 179.45 179.19 3ito n GLY 209 N -0.95 0.61 3.72 3.86 0.00 -0.20 -4.92 105.19 107.31 3ito n GLY 209 Ca -0.02 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 3ito n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ito s LEU 210 N -1.36 4.42 1.05 0.99 1.43 -0.88 -5.02 118.68 119.31 3ito s LEU 210 Ca 0.31 1.64 -0.12 0.00 -1.03 0.00 0.00 54.13 54.92 3ito s LEU 210 Cb 0.17 -3.49 0.22 0.00 0.03 0.00 0.00 46.19 43.12 3ito s LEU 210 CO 0.24 -0.14 1.07 -2.84 0.23 0.00 0.00 176.35 174.91 3ito s PRO 211 N 0.48 -0.02 0.40 1.29 0.02 -1.26 -4.90 135.00 131.01 3ito s PRO 211 Ca 0.47 0.73 0.08 0.00 0.02 0.00 0.00 61.00 62.30 3ito s PRO 211 Cb -0.21 -1.67 0.85 0.00 0.02 0.00 0.00 34.50 33.49 3ito s PRO 211 CO 0.27 -3.09 2.03 -0.44 -0.33 0.00 0.00 177.00 175.44 3ito h ASP 212 N -2.16 0.51 -0.57 2.53 3.32 -2.01 -2.65 116.42 115.39 3ito h ASP 212 Ca -0.56 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.48 3ito h ASP 212 Cb 1.32 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.76 3ito h ASP 212 CO 0.54 0.35 0.00 -0.90 -1.72 0.00 0.00 179.24 177.51 3ito n ASP 213 N -4.47 5.16 -4.94 6.45 5.75 -1.26 -4.97 116.55 118.26 3ito n ASP 213 Ca 0.06 -2.75 -0.22 0.00 -0.01 0.00 0.00 54.79 51.87 3ito n ASP 213 Cb 0.14 -0.62 -0.03 0.00 -1.03 0.00 0.00 41.12 39.58 3ito n ASP 213 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3ito s TRP 214 N -2.41 3.40 0.09 2.11 0.52 -1.00 -4.89 118.94 116.76 3ito s TRP 214 Ca 0.52 -0.01 0.07 0.00 0.02 0.00 0.00 56.10 56.70 3ito s TRP 214 Cb 0.37 -1.56 -0.03 0.00 -1.15 0.00 0.00 33.47 31.10 3ito s TRP 214 CO 0.18 0.47 -0.19 0.15 0.02 0.00 0.00 176.95 177.58 3ito s LYS 215 N -3.82 1.04 -0.22 4.98 1.02 -0.82 -4.83 119.74 117.09 3ito s LYS 215 Ca 0.34 -1.11 -0.01 0.00 0.02 0.00 0.00 55.97 55.21 3ito s LYS 215 Cb -0.09 -1.24 0.02 0.00 -0.52 0.00 0.00 37.83 36.00 3ito s LYS 215 CO 0.28 0.29 -0.11 -1.17 -0.92 0.00 0.00 175.35 173.71 3ito s LEU 216 N -1.87 2.78 -0.19 3.17 2.96 0.66 -1.60 118.68 124.59 3ito s LEU 216 Ca 0.04 -0.76 -0.07 0.00 -0.22 0.00 0.00 54.13 53.12 3ito s LEU 216 Cb -0.10 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.96 3ito s LEU 216 CO 0.04 -0.07 0.04 -0.36 -1.32 0.00 0.00 176.35 174.68 3ito s PHE 217 N 1.32 3.15 -0.08 5.38 0.08 0.21 -1.25 117.98 126.78 3ito s PHE 217 Ca 0.02 -0.15 -0.02 0.00 0.12 0.00 0.00 56.93 56.90 3ito s PHE 217 Cb -0.15 -2.09 -0.03 0.00 -0.57 0.00 0.00 43.02 40.17 3ito s PHE 217 CO -0.07 -0.03 0.01 -1.54 -0.10 0.00 0.00 175.22 173.49 3ito s SER 218 N 0.71 5.30 -0.18 1.36 1.04 -0.88 0.37 113.70 121.42 3ito s SER 218 Ca 0.02 0.15 -0.00 0.00 0.48 0.00 0.00 55.95 56.60 3ito s SER 218 Cb -0.14 -1.50 0.00 0.00 0.10 0.00 0.00 66.02 64.49 3ito s SER 218 CO 0.02 0.37 -0.15 -0.70 0.98 0.00 0.00 173.24 173.76 3ito s GLU 219 N -0.96 3.17 0.38 4.02 2.12 -0.86 -1.15 118.70 125.42 3ito s GLU 219 Ca 0.14 -0.75 -0.08 0.00 0.36 0.00 0.00 54.97 54.64 3ito s GLU 219 Cb -0.11 -2.68 -0.06 0.00 0.26 0.00 0.00 34.13 31.54 3ito s GLU 219 CO 0.03 -0.10 0.70 -3.38 -0.54 0.00 0.00 175.26 171.97 3ito s HIS 220 N 1.10 3.48 -0.27 5.30 -3.43 -1.26 -4.69 115.29 115.52 3ito s HIS 220 Ca 0.00 0.89 -0.13 0.00 -0.80 0.00 0.00 55.06 55.02 3ito s HIS 220 Cb -0.14 -2.32 0.09 0.00 -1.43 0.00 0.00 32.58 28.79 3ito s HIS 220 CO -0.05 -0.03 0.64 0.21 -2.00 0.00 0.00 174.74 173.50 3ito s LYS 221 N -3.85 0.62 0.17 -0.38 2.20 -0.13 -4.76 119.74 113.61 3ito s LYS 221 Ca 0.48 1.25 -0.15 0.00 -0.36 0.00 0.00 55.97 57.20 3ito s LYS 221 Cb -0.10 0.37 0.09 0.00 -1.51 0.00 0.00 37.83 36.67 3ito s LYS 221 CO 0.32 -0.17 1.77 1.98 -0.36 0.00 0.00 175.35 178.89 3ito h MET 222 N 7.39 0.39 -2.96 4.03 1.85 -1.07 -3.36 114.93 121.21 3ito h MET 222 Ca -0.26 -0.02 0.07 0.00 -0.61 0.00 0.00 59.70 58.88 3ito h MET 222 Cb 1.18 -0.09 -0.06 0.00 0.43 0.00 0.00 31.60 33.06 3ito h MET 222 CO 0.15 0.26 0.24 1.52 -0.40 0.00 0.00 176.91 178.68 3ito s TYR 223 N -6.15 -0.21 0.02 1.39 1.13 -1.26 -4.49 117.35 107.79 3ito s TYR 223 Ca -0.13 -0.23 0.00 0.00 -1.41 0.00 0.00 57.07 55.30 3ito s TYR 223 Cb 0.13 0.70 0.00 0.00 -1.10 0.00 0.00 41.96 41.68 3ito s TYR 223 CO 0.72 -1.19 0.00 -1.91 -2.51 0.00 0.00 175.55 170.66 3ito n GLU 224 N -0.46 -0.80 0.13 -3.49 2.13 -1.26 -4.82 120.64 112.07 3ito n GLU 224 Ca -0.05 1.00 0.12 0.00 0.66 0.00 0.00 57.16 58.89 3ito n GLU 224 Cb 0.59 -0.73 0.49 0.00 0.27 0.00 0.00 31.44 32.06 3ito n GLU 224 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3ito n PRO 225 N 0.28 0.20 -3.02 5.31 -0.04 -1.26 -4.98 135.00 131.48 3ito n PRO 225 Ca 0.00 0.41 -0.40 0.00 -0.04 0.00 0.00 63.50 63.47 3ito n PRO 225 Cb 0.00 -1.87 -0.05 0.00 -0.04 0.00 0.00 33.50 31.54 3ito n PRO 225 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ito s ALA 226 N -3.31 3.38 -1.45 0.55 0.00 -1.26 -4.96 121.76 114.71 3ito s ALA 226 Ca 0.05 0.09 0.17 0.00 0.00 0.00 0.00 51.96 52.27 3ito s ALA 226 Cb 0.09 -3.01 0.51 0.00 0.00 0.00 0.00 23.12 20.72 3ito s ALA 226 CO 0.41 -0.23 1.43 1.19 0.00 0.00 0.00 175.76 178.55 3ito n PHE 227 N 4.12 0.80 0.04 0.00 3.72 -1.22 -4.56 117.46 120.37 3ito n PHE 227 Ca -0.00 -0.51 0.00 0.00 -0.05 0.00 0.00 57.45 56.88 3ito n PHE 227 Cb 0.51 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.02 3ito n PHE 227 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 3ito n TYR 228 N 1.11 -0.37 -4.00 1.38 9.36 -0.48 -4.93 117.16 119.23 3ito n TYR 228 Ca 0.19 0.07 -0.08 0.00 3.32 0.00 0.00 57.90 61.39 3ito n TYR 228 Cb 0.56 0.13 -0.10 0.00 -0.63 0.00 0.00 39.34 39.30 3ito n TYR 228 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3ito s SER 229 N -5.47 0.31 -0.03 2.98 1.04 -0.57 -4.98 113.70 106.97 3ito s SER 229 Ca 0.00 -0.66 0.02 0.00 0.48 0.00 0.00 55.95 55.79 3ito s SER 229 Cb 0.00 0.16 0.01 0.00 0.10 0.00 0.00 66.02 66.28 3ito s SER 229 CO 0.00 -0.44 -0.08 -0.89 0.98 0.00 0.00 173.24 172.81 3ito s THR 230 N -2.47 0.71 0.10 2.02 2.01 -1.26 -0.49 115.64 116.26 3ito s THR 230 Ca -0.06 -0.31 -0.30 0.00 0.31 0.00 0.00 61.69 61.32 3ito s THR 230 Cb -0.02 -0.65 -0.13 0.00 0.01 0.00 0.00 72.50 71.71 3ito s THR 230 CO -0.05 0.23 1.63 0.58 -0.69 0.00 0.00 174.62 176.32 3ito h VAL 231 N 5.48 0.35 -2.94 3.82 2.07 -1.72 -3.00 116.25 120.31 3ito h VAL 231 Ca -0.33 0.00 -0.80 0.00 0.82 0.00 0.00 66.70 66.39 3ito h VAL 231 Cb 1.17 0.35 -0.26 0.00 -1.52 0.00 0.00 31.29 31.04 3ito h VAL 231 CO 0.49 0.00 0.84 0.52 0.02 0.00 0.00 177.57 179.43 3ito n VAL 232 N -5.43 4.89 0.06 2.57 0.31 -1.26 -4.83 118.33 114.65 3ito n VAL 232 Ca -0.09 -5.49 -0.11 0.00 -0.01 0.00 0.00 64.34 58.63 3ito n VAL 232 Cb 0.33 -2.32 -0.13 0.00 -0.91 0.00 0.00 33.84 30.81 3ito n VAL 232 CO 0.00 0.00 0.00 0.06 -1.32 0.00 0.00 176.83 175.57 3ito h GLN 233 N 6.03 0.11 0.00 5.55 -0.00 -1.68 -0.31 115.11 124.81 3ito h GLN 233 Ca 0.22 -0.19 -0.28 0.00 -0.00 0.00 0.00 58.65 58.40 3ito h GLN 233 Cb 0.73 0.07 -0.07 0.00 -0.00 0.00 0.00 27.48 28.21 3ito h GLN 233 CO 1.24 1.02 -0.16 -0.40 -0.00 0.00 0.00 178.83 180.54 3ito n ASP 234 N -3.38 -1.26 0.29 0.06 5.68 -1.26 -2.04 116.55 114.64 3ito n ASP 234 Ca -0.06 -2.84 0.18 0.00 -0.50 0.00 0.00 54.79 51.57 3ito n ASP 234 Cb 0.99 2.38 0.82 0.00 -1.14 0.00 0.00 41.12 44.16 3ito n ASP 234 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 3ito h TRP 235 N 1.98 0.00 0.01 2.11 5.08 -1.94 -1.67 115.95 121.51 3ito h TRP 235 Ca -0.26 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.71 3ito h TRP 235 Cb 1.14 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.30 3ito h TRP 235 CO 0.00 0.03 -0.00 0.78 -1.28 0.00 0.00 178.44 177.96 3ito h GLY 236 N 1.41 -0.01 1.13 11.11 0.00 -1.99 0.14 103.07 114.85 3ito h GLY 236 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.26 3ito h GLY 236 CO 0.00 -0.00 0.11 -0.84 0.00 0.00 0.00 176.54 175.81 3ito h THR 237 N -0.34 1.26 -0.85 4.70 2.02 -1.89 -2.33 112.91 115.49 3ito h THR 237 Ca -0.00 -1.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.15 3ito h THR 237 Cb 0.34 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 67.35 3ito h THR 237 CO 0.00 0.38 0.48 -1.13 0.37 0.00 0.00 175.52 175.62 3ito h ASN 238 N 1.00 1.04 -0.59 4.18 -1.24 -1.12 -0.93 115.58 117.92 3ito h ASN 238 Ca 0.20 -0.09 -0.05 0.00 0.71 0.00 0.00 56.30 57.08 3ito h ASN 238 Cb 0.42 -0.27 -0.02 0.00 0.73 0.00 0.00 38.32 39.18 3ito h ASN 238 CO 0.01 0.83 0.19 0.22 -1.29 0.00 0.00 177.43 177.39 3ito h TYR 239 N 1.17 0.94 -0.84 0.67 3.20 -0.47 -1.45 116.97 120.20 3ito h TYR 239 Ca 0.30 -0.09 0.03 0.00 3.14 0.00 0.00 58.73 62.11 3ito h TYR 239 Cb 0.00 -0.27 -0.05 0.00 1.54 0.00 0.00 36.73 37.95 3ito h TYR 239 CO 0.00 0.78 0.55 -0.07 -1.64 0.00 0.00 178.16 177.79 3ito h LEU 240 N 0.83 0.90 0.36 2.82 3.38 -0.82 -0.16 115.31 122.61 3ito h LEU 240 Ca 0.19 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 3ito h LEU 240 Cb 0.28 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3ito h LEU 240 CO -0.01 0.62 -0.17 0.40 0.09 0.00 0.00 178.44 179.37 3ito h ILE 241 N 1.05 0.63 -0.68 1.22 2.04 -0.63 -1.69 117.51 119.45 3ito h ILE 241 Ca 0.33 -0.46 0.01 0.00 1.00 0.00 0.00 64.86 65.74 3ito h ILE 241 Cb 0.02 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 3ito h ILE 241 CO -0.10 0.09 0.45 0.00 0.00 0.00 0.00 178.15 178.59 3ito h ALA 242 N -0.23 0.87 -0.70 1.87 0.00 -1.06 -0.04 119.26 119.96 3ito h ALA 242 Ca -0.05 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3ito h ALA 242 Cb 0.51 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3ito h ALA 242 CO 0.08 0.28 0.17 0.37 0.00 0.00 0.00 179.25 180.16 3ito h GLN 243 N 0.92 1.12 -0.36 0.00 5.75 -1.07 -2.61 115.11 118.86 3ito h GLN 243 Ca 0.25 -0.27 -0.09 0.00 -0.15 0.00 0.00 58.65 58.39 3ito h GLN 243 Cb -0.10 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.29 3ito h GLN 243 CO -0.06 0.99 -0.14 1.15 -2.65 0.00 0.00 178.83 178.13 3ito h THR 244 N 1.06 1.28 -0.32 2.39 2.02 -0.87 -3.31 112.91 115.15 3ito h THR 244 Ca 0.22 -1.24 -0.09 0.00 0.77 0.00 0.00 66.41 66.08 3ito h THR 244 Cb 0.37 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 3ito h THR 244 CO 0.00 0.41 -0.14 -0.07 0.37 0.00 0.00 175.52 176.09 3ito h LEU 245 N 0.52 0.68 0.00 2.58 3.38 -0.94 -3.50 115.31 118.03 3ito h LEU 245 Ca 0.08 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3ito h LEU 245 Cb 0.66 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3ito h LEU 245 CO 0.05 0.93 0.00 0.61 0.09 0.00 0.00 178.44 180.11 3ito n GLY 246 N -0.07 1.69 0.44 0.83 0.00 -0.99 -4.91 105.19 102.17 3ito n GLY 246 Ca -0.03 -1.93 0.26 0.00 0.00 0.00 0.00 46.02 44.32 3ito n GLY 246 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ito h PRO 247 N 0.00 0.24 -0.00 1.61 0.11 -1.91 -0.69 132.00 131.36 3ito h PRO 247 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3ito h PRO 247 Cb 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.06 3ito h PRO 247 CO 0.00 0.16 -0.08 1.63 -0.21 0.00 0.00 178.00 179.50 3ito n LYS 248 N -4.46 0.68 -3.84 1.05 5.02 -1.26 -4.79 118.16 110.57 3ito n LYS 248 Ca 0.24 -0.19 -0.35 0.00 -2.02 0.00 0.00 58.31 55.99 3ito n LYS 248 Cb 0.96 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 34.38 3ito n LYS 248 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ito s ALA 249 N -2.45 3.53 0.30 7.82 0.00 -0.27 -0.24 121.76 130.46 3ito s ALA 249 Ca 0.30 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.53 3ito s ALA 249 Cb 0.20 -2.09 -0.03 0.00 0.00 0.00 0.00 23.12 21.20 3ito s ALA 249 CO 0.46 0.07 0.19 -0.65 0.00 0.00 0.00 175.76 175.84 3ito s GLN 250 N 0.55 1.60 -0.08 0.00 -0.21 -0.38 -4.72 119.66 116.41 3ito s GLN 250 Ca 0.06 -1.91 -0.02 0.00 0.02 0.00 0.00 55.36 53.51 3ito s GLN 250 Cb -0.12 0.09 -0.03 0.00 1.00 0.00 0.00 33.01 33.94 3ito s GLN 250 CO 0.00 -0.51 -0.01 0.00 -2.12 0.00 0.00 175.29 172.66 3ito s LEU 252 N -0.87 3.94 -0.32 0.00 1.43 -0.30 -0.23 118.68 122.34 3ito s LEU 252 Ca 0.13 0.12 -0.09 0.00 -1.03 0.00 0.00 54.13 53.26 3ito s LEU 252 Cb -0.11 -2.01 -0.00 0.00 0.03 0.00 0.00 46.19 44.10 3ito s LEU 252 CO 0.02 0.17 0.15 -0.69 0.23 0.00 0.00 176.35 176.23 3ito s VAL 253 N 0.41 4.50 -0.30 -1.59 1.01 0.34 -4.07 120.40 120.69 3ito s VAL 253 Ca 0.05 -0.51 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 3ito s VAL 253 Cb -0.12 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.92 3ito s VAL 253 CO -0.00 0.03 0.15 -0.62 0.00 0.00 0.00 175.10 174.67 3ito s ASP 254 N 1.59 5.63 0.28 3.32 -1.08 -1.26 0.05 116.67 125.20 3ito s ASP 254 Ca 0.04 -0.34 0.01 0.00 -0.52 0.00 0.00 52.55 51.74 3ito s ASP 254 Cb -0.17 -2.03 0.67 0.00 -1.46 0.00 0.00 42.92 39.93 3ito s ASP 254 CO 0.06 -0.14 1.63 0.25 0.52 0.00 0.00 175.17 177.50 3ito h LEU 255 N 8.35 -0.11 -0.81 -1.34 6.46 -1.80 -1.34 115.31 124.73 3ito h LEU 255 Ca -0.34 0.21 0.00 0.00 -0.12 0.00 0.00 57.88 57.63 3ito h LEU 255 Cb 1.16 0.31 0.00 0.00 -0.73 0.00 0.00 40.66 41.40 3ito h LEU 255 CO 0.60 -0.19 0.00 0.61 -0.62 0.00 0.00 178.44 178.84 3ito n GLY 256 N -1.40 0.26 1.83 3.75 0.00 -1.26 -4.11 105.19 104.27 3ito n GLY 256 Ca 0.20 -0.17 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 3ito n GLY 256 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ito n HIS 257 N -0.01 2.27 -4.43 1.61 8.25 -0.50 -3.65 115.22 118.75 3ito n HIS 257 Ca 0.05 -1.38 -0.24 0.00 -0.26 0.00 0.00 57.72 55.89 3ito n HIS 257 Cb 0.21 -0.69 -0.09 0.00 1.12 0.00 0.00 29.99 30.54 3ito n HIS 257 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3ito s HIS 258 N -3.09 2.41 0.73 4.41 3.76 -1.26 -2.44 115.29 119.81 3ito s HIS 258 Ca 0.53 -0.35 -0.14 0.00 -0.15 0.00 0.00 55.06 54.95 3ito s HIS 258 Cb 0.44 -1.14 0.04 0.00 1.11 0.00 0.00 32.58 33.02 3ito s HIS 258 CO 0.11 0.65 1.15 0.00 -0.85 0.00 0.00 174.74 175.80 3ito s ALA 259 N -2.49 2.19 0.39 -1.40 0.00 -1.26 -4.92 121.76 114.27 3ito s ALA 259 Ca 0.31 0.65 -0.26 0.00 0.00 0.00 0.00 51.96 52.67 3ito s ALA 259 Cb -0.04 -3.39 -0.11 0.00 0.00 0.00 0.00 23.12 19.59 3ito s ALA 259 CO 0.17 -1.74 1.15 -2.30 0.00 0.00 0.00 175.76 173.04 3ito n PRO 260 N -2.86 1.68 -0.37 0.00 -0.02 -1.26 -2.18 135.00 129.99 3ito n PRO 260 Ca 0.12 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3ito n PRO 260 Cb 0.51 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 3ito n PRO 260 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3ito n ASN 261 N 0.54 0.00 -4.58 2.55 3.02 -1.26 -4.98 115.26 110.56 3ito n ASN 261 Ca 0.08 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.20 3ito n ASN 261 Cb 0.38 -0.87 -0.00 0.00 -0.61 0.00 0.00 39.78 38.68 3ito n ASN 261 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3ito n THR 262 N -2.00 2.16 -2.98 3.41 -1.04 -0.92 -4.88 114.28 108.02 3ito n THR 262 Ca 0.00 -0.50 -0.44 0.00 -2.04 0.00 0.00 64.05 61.07 3ito n THR 262 Cb 0.00 -0.99 -0.03 0.00 -1.82 0.00 0.00 70.33 67.49 3ito n THR 262 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3ito s ASN 263 N -0.70 6.36 0.16 8.00 3.84 -1.26 -4.87 114.94 126.46 3ito s ASN 263 Ca 0.61 -1.56 -0.07 0.00 0.21 0.00 0.00 52.86 52.05 3ito s ASN 263 Cb -0.62 -2.36 0.03 0.00 -0.55 0.00 0.00 41.25 37.74 3ito s ASN 263 CO 0.58 -1.17 1.47 0.40 -2.79 0.00 0.00 177.10 175.59 3ito h ILE 264 N 5.84 1.29 -0.06 -5.21 2.04 -1.98 -3.11 117.51 116.33 3ito h ILE 264 Ca -0.12 -1.72 -0.00 0.00 1.00 0.00 0.00 64.86 64.02 3ito h ILE 264 Cb 1.06 1.64 -0.00 0.00 -0.74 0.00 0.00 36.82 38.78 3ito h ILE 264 CO 1.11 0.55 0.02 1.05 0.00 0.00 0.00 178.15 180.88 3ito h GLU 265 N 0.57 0.08 -0.35 2.37 9.09 -1.90 -1.42 114.58 123.01 3ito h GLU 265 Ca 0.02 -0.01 -0.15 0.00 0.05 0.00 0.00 59.36 59.27 3ito h GLU 265 Cb 1.08 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 28.16 3ito h GLU 265 CO 0.11 0.07 -0.38 1.98 0.05 0.00 0.00 179.01 180.83 3ito h MET 266 N 0.08 0.85 -0.87 1.06 4.05 -1.94 -1.81 114.93 116.35 3ito h MET 266 Ca 0.02 -0.44 0.00 0.00 -0.28 0.00 0.00 59.70 59.00 3ito h MET 266 Cb 0.02 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.79 3ito h MET 266 CO -0.00 1.08 0.55 0.82 0.23 0.00 0.00 176.91 179.59 3ito h ILE 267 N 0.70 1.23 -0.25 1.77 2.04 -1.29 -0.20 117.51 121.52 3ito h ILE 267 Ca 0.06 -0.46 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 3ito h ILE 267 Cb 0.96 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3ito h ILE 267 CO 0.09 0.23 0.15 0.58 0.00 0.00 0.00 178.15 179.21 3ito h VAL 268 N 1.19 1.09 -0.45 1.67 2.07 -1.12 -1.68 116.25 119.01 3ito h VAL 268 Ca 0.32 -0.20 0.01 0.00 0.82 0.00 0.00 66.70 67.65 3ito h VAL 268 Cb -0.10 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 3ito h VAL 268 CO -0.06 0.09 0.29 0.00 0.02 0.00 0.00 177.57 177.90 3ito h ALA 269 N 1.06 0.58 -0.41 1.67 0.00 -0.77 -1.39 119.26 120.00 3ito h ALA 269 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3ito h ALA 269 Cb 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3ito h ALA 269 CO -0.02 -0.01 0.27 0.00 0.00 0.00 0.00 179.25 179.49 3ito h ARG 270 N 0.58 0.54 -0.47 0.00 2.47 -0.85 -0.30 114.38 116.34 3ito h ARG 270 Ca 0.17 -0.03 -0.06 0.00 -1.26 0.00 0.00 59.98 58.80 3ito h ARG 270 Cb -0.03 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.14 3ito h ARG 270 CO -0.06 0.36 0.05 -0.07 0.56 0.00 0.00 179.97 180.81 3ito h LEU 271 N 0.55 0.71 -0.50 3.04 3.38 -1.10 -2.29 115.31 119.09 3ito h LEU 271 Ca 0.15 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 3ito h LEU 271 Cb -0.06 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 3ito h LEU 271 CO -0.03 0.74 -0.07 0.40 0.09 0.00 0.00 178.44 179.58 3ito h ILE 272 N 0.71 1.27 -0.62 1.22 2.04 -0.83 0.11 117.51 121.42 3ito h ILE 272 Ca 0.15 -1.19 -0.00 0.00 1.00 0.00 0.00 64.86 64.82 3ito h ILE 272 Cb 0.36 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 3ito h ILE 272 CO 0.01 0.42 0.37 -0.61 0.00 0.00 0.00 178.15 178.33 3ito h GLN 273 N 0.79 0.83 -0.62 2.37 4.15 -0.65 -2.23 115.11 119.76 3ito h GLN 273 Ca 0.13 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.48 3ito h GLN 273 Cb 0.61 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.12 3ito h GLN 273 CO 0.04 0.59 0.00 1.19 -1.93 0.00 0.00 178.83 178.72 3ito n PHE 274 N -4.41 1.84 -2.51 3.99 3.72 -0.90 -4.95 117.46 114.24 3ito n PHE 274 Ca 0.06 -0.67 -0.20 0.00 -0.05 0.00 0.00 57.45 56.59 3ito n PHE 274 Cb 0.07 -0.40 -0.00 0.00 -0.94 0.00 0.00 39.48 38.21 3ito n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ito n GLY 275 N 0.84 -0.50 0.09 1.37 0.00 -0.75 -4.90 105.19 101.34 3ito n GLY 275 Ca 0.27 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.39 3ito n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ito n LYS 276 N -3.15 1.39 -2.80 1.61 4.76 0.31 -4.90 118.16 115.37 3ito n LYS 276 Ca -0.21 -2.30 -0.43 0.00 -2.87 0.00 0.00 58.31 52.50 3ito n LYS 276 Cb 0.67 -1.35 -0.03 0.00 -1.84 0.00 0.00 35.03 32.48 3ito n LYS 276 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3ito s LEU 277 N -2.39 4.34 0.12 -0.35 2.96 -1.17 -0.13 118.68 122.06 3ito s LEU 277 Ca 0.25 -1.33 -0.08 0.00 -0.22 0.00 0.00 54.13 52.75 3ito s LEU 277 Cb 0.22 -2.45 -0.10 0.00 0.50 0.00 0.00 46.19 44.36 3ito s LEU 277 CO 0.02 -1.38 1.31 1.23 -1.32 0.00 0.00 176.35 176.22 3ito h GLY 278 N 11.44 0.66 0.00 7.98 0.00 -0.90 -3.41 103.07 118.84 3ito h GLY 278 Ca -0.08 -1.02 0.00 0.00 0.00 0.00 0.00 47.33 46.23 3ito h GLY 278 CO 1.20 0.91 0.00 0.61 0.00 0.00 0.00 176.54 179.26 3ito n GLY 279 N 0.80 0.51 3.10 4.60 0.00 -1.15 -0.85 105.19 112.20 3ito n GLY 279 Ca -0.07 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 3ito n GLY 279 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3ito s PHE 280 N -2.00 2.14 -0.34 1.61 2.19 -1.25 -0.51 117.98 119.82 3ito s PHE 280 Ca 0.00 -0.97 -0.15 0.00 0.33 0.00 0.00 56.93 56.14 3ito s PHE 280 Cb 0.00 -1.50 -0.01 0.00 -1.31 0.00 0.00 43.02 40.20 3ito s PHE 280 CO 0.00 -0.46 0.36 -1.01 1.83 0.00 0.00 175.22 175.94 3ito s HIS 281 N 0.78 3.21 0.19 10.12 3.76 0.11 -2.46 115.29 131.00 3ito s HIS 281 Ca -0.10 -0.01 -0.20 0.00 -0.15 0.00 0.00 55.06 54.59 3ito s HIS 281 Cb -0.16 -2.66 -0.08 0.00 1.11 0.00 0.00 32.58 30.80 3ito s HIS 281 CO 0.01 -0.42 0.70 -0.06 -0.85 0.00 0.00 174.74 174.13 3ito s PHE 282 N 2.01 3.70 0.00 1.40 0.08 0.01 -2.45 117.98 122.72 3ito s PHE 282 Ca 0.12 1.38 0.00 0.00 0.12 0.00 0.00 56.93 58.55 3ito s PHE 282 Cb -0.17 -2.61 0.00 0.00 -0.57 0.00 0.00 43.02 39.68 3ito s PHE 282 CO 0.12 0.39 0.00 0.27 -0.10 0.00 0.00 175.22 175.90 3ito n ASN 283 N 0.95 0.00 -4.40 1.36 0.23 -1.26 -1.52 115.26 110.61 3ito n ASN 283 Ca -0.04 0.00 -0.20 0.00 -0.53 0.00 0.00 54.58 53.81 3ito n ASN 283 Cb 0.51 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.10 3ito n ASN 283 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3ito s ASP 284 N 0.00 2.15 0.16 0.53 -1.08 0.80 -4.61 116.67 114.62 3ito s ASP 284 Ca 0.00 -1.32 -0.25 0.00 -0.52 0.00 0.00 52.55 50.47 3ito s ASP 284 Cb 0.00 -0.04 0.06 0.00 -1.46 0.00 0.00 42.92 41.48 3ito s ASP 284 CO 0.00 -0.57 0.92 -0.94 0.52 0.00 0.00 175.17 175.10 3ito s SER 285 N -3.42 -0.21 0.00 -0.34 1.04 -1.26 -1.21 113.70 108.31 3ito s SER 285 Ca 0.34 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.36 3ito s SER 285 Cb 0.07 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.71 3ito s SER 285 CO 0.13 -0.95 0.00 1.17 0.98 0.00 0.00 173.24 174.57 3ito n LYS 286 N -0.46 1.14 0.01 4.02 4.81 -1.26 -4.77 118.16 121.65 3ito n LYS 286 Ca -0.06 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.35 3ito n LYS 286 Cb 0.61 -0.58 -0.01 0.00 0.02 0.00 0.00 35.03 35.06 3ito n LYS 286 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3ito n TYR 287 N -0.69 0.00 0.00 5.64 4.01 -1.26 -5.10 117.16 119.76 3ito n TYR 287 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3ito n TYR 287 Cb 0.07 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 38.97 3ito n TYR 287 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ito n GLY 288 N 2.96 5.50 2.80 2.72 0.00 -1.26 -4.91 105.19 113.00 3ito n GLY 288 Ca -0.05 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 3ito n GLY 288 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3ito n ASP 289 N 0.00 4.56 0.25 1.61 4.64 -1.24 -4.73 116.55 121.65 3ito n ASP 289 Ca 0.00 -2.99 0.13 0.00 -1.38 0.00 0.00 54.79 50.54 3ito n ASP 289 Cb 0.00 -1.56 0.63 0.00 -1.04 0.00 0.00 41.12 39.15 3ito n ASP 289 CO 0.00 0.00 0.00 0.44 -0.82 0.00 0.00 177.20 176.82 3ito h ASP 290 N 5.84 0.00 -5.51 1.67 3.32 -1.84 -3.47 116.42 116.43 3ito h ASP 290 Ca 0.47 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 57.10 3ito h ASP 290 Cb 0.63 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.19 3ito h ASP 290 CO 1.74 0.15 -0.66 0.47 -1.72 0.00 0.00 179.24 179.22 3ito n ASP 291 N -3.43 -5.21 -4.90 6.45 8.00 -1.23 -4.76 116.55 111.47 3ito n ASP 291 Ca -0.01 -0.51 -0.28 0.00 0.71 0.00 0.00 54.79 54.70 3ito n ASP 291 Cb 0.32 -4.19 0.04 0.00 -0.02 0.00 0.00 41.12 37.28 3ito n ASP 291 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ito s LEU 292 N -6.94 3.02 0.06 0.64 1.43 -0.35 -0.80 118.68 115.75 3ito s LEU 292 Ca 0.49 0.89 -0.35 0.00 -1.03 0.00 0.00 54.13 54.12 3ito s LEU 292 Cb -0.24 -3.67 -0.14 0.00 0.03 0.00 0.00 46.19 42.17 3ito s LEU 292 CO 0.61 -1.26 1.58 0.47 0.23 0.00 0.00 176.35 177.97 3ito n ASP 293 N -2.83 2.71 -4.57 2.29 9.92 -1.26 -0.14 116.55 122.67 3ito n ASP 293 Ca 0.06 1.07 -0.49 0.00 -0.53 0.00 0.00 54.79 54.90 3ito n ASP 293 Cb 0.58 -1.33 -0.04 0.00 -0.64 0.00 0.00 41.12 39.68 3ito n ASP 293 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3ito n ALA 294 N 3.88 -0.93 -0.84 2.24 0.00 -1.26 -1.48 120.51 122.12 3ito n ALA 294 Ca 0.19 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.10 3ito n ALA 294 Cb 0.25 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.69 3ito n ALA 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ito n GLY 295 N 1.98 0.28 0.23 0.00 0.00 -1.26 -4.75 105.19 101.67 3ito n GLY 295 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 3ito n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ito h ALA 296 N 0.00 1.00 0.00 4.61 0.00 -1.62 -3.30 119.26 119.95 3ito h ALA 296 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 3ito h ALA 296 Cb 0.30 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3ito h ALA 296 CO 0.00 0.00 -1.63 -0.89 0.00 0.00 0.00 179.25 176.73 3ito n ILE 297 N -3.05 0.62 -3.53 0.00 2.08 -1.26 -4.91 119.36 109.31 3ito n ILE 297 Ca 0.03 -0.18 -0.27 0.00 0.56 0.00 0.00 62.75 62.89 3ito n ILE 297 Cb 0.47 -1.46 -0.10 0.00 -0.75 0.00 0.00 39.64 37.80 3ito n ILE 297 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3ito n GLU 298 N -3.33 0.78 0.21 0.38 1.02 -1.26 -4.98 120.64 113.46 3ito n GLU 298 Ca -0.22 -3.61 0.05 0.00 -0.02 0.00 0.00 57.16 53.36 3ito n GLU 298 Cb 0.67 -1.85 0.50 0.00 -0.02 0.00 0.00 31.44 30.74 3ito n GLU 298 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3ito h PRO 299 N 5.41 0.04 -0.48 3.49 0.13 -1.91 -2.86 132.00 135.83 3ito h PRO 299 Ca 0.22 -0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 65.22 3ito h PRO 299 Cb 0.85 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 3ito h PRO 299 CO 0.49 0.20 -0.19 -0.92 -0.23 0.00 0.00 178.00 177.35 3ito h TYR 300 N 0.04 1.08 -0.88 1.56 3.20 -1.93 -1.45 116.97 118.59 3ito h TYR 300 Ca 0.01 -0.25 -0.00 0.00 3.14 0.00 0.00 58.73 61.63 3ito h TYR 300 Cb 0.30 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.27 3ito h TYR 300 CO 0.00 1.05 0.55 -0.09 -1.64 0.00 0.00 178.16 178.03 3ito h ARG 301 N 0.83 1.18 -0.60 1.82 2.43 -1.94 0.24 114.38 118.34 3ito h ARG 301 Ca 0.11 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.11 3ito h ARG 301 Cb 0.76 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 3ito h ARG 301 CO 0.06 0.81 0.06 1.25 -1.51 0.00 0.00 179.97 180.65 3ito h LEU 302 N 1.21 0.98 -0.72 3.80 5.85 -1.34 -1.47 115.31 123.61 3ito h LEU 302 Ca 0.32 -0.28 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 3ito h LEU 302 Cb -0.08 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.66 3ito h LEU 302 CO -0.06 1.01 0.20 0.15 -0.34 0.00 0.00 178.44 179.40 3ito h PHE 303 N 0.91 1.19 -0.07 1.25 3.57 -0.19 -1.86 116.94 121.74 3ito h PHE 303 Ca 0.18 -0.13 -0.07 0.00 3.53 0.00 0.00 57.97 61.48 3ito h PHE 303 Cb 0.47 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3ito h PHE 303 CO 0.03 0.95 -0.28 -0.07 -2.23 0.00 0.00 178.31 176.71 3ito h LEU 304 N 1.08 0.12 -0.20 0.59 3.38 -0.20 0.15 115.31 120.22 3ito h LEU 304 Ca 0.23 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.09 3ito h LEU 304 Cb 0.34 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 3ito h LEU 304 CO -0.00 0.40 -0.17 0.58 0.09 0.00 0.00 178.44 179.34 3ito h VAL 305 N 0.11 1.32 0.00 1.22 2.07 -0.95 -2.85 116.25 117.17 3ito h VAL 305 Ca 0.02 -1.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.21 3ito h VAL 305 Cb 0.56 1.73 -0.00 0.00 -1.52 0.00 0.00 31.29 32.05 3ito h VAL 305 CO 0.04 0.40 -0.08 -0.26 0.02 0.00 0.00 177.57 177.69 3ito h PHE 306 N 0.16 0.00 -0.59 1.57 0.04 -0.80 -1.91 116.94 115.40 3ito h PHE 306 Ca 0.04 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.72 3ito h PHE 306 Cb 0.70 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.83 3ito h PHE 306 CO 0.08 0.08 0.01 -0.97 -0.60 0.00 0.00 178.31 176.90 3ito h ASN 307 N 0.00 0.99 0.10 2.17 -1.24 -0.50 0.14 115.58 117.25 3ito h ASN 307 Ca -0.00 -0.27 -0.17 0.00 0.71 0.00 0.00 56.30 56.57 3ito h ASN 307 Cb 0.43 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.21 3ito h ASN 307 CO 0.01 1.04 -0.60 -0.33 -1.29 0.00 0.00 177.43 176.26 3ito h GLU 308 N 0.94 0.50 -0.21 6.67 4.39 -1.25 -2.02 114.58 123.59 3ito h GLU 308 Ca 0.17 -0.34 -0.08 0.00 0.34 0.00 0.00 59.36 59.45 3ito h GLU 308 Cb 0.53 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.22 3ito h GLU 308 CO 0.03 0.95 -0.16 -0.07 -1.16 0.00 0.00 179.01 178.60 3ito h LEU 309 N 0.37 0.51 -0.69 1.33 3.38 -1.08 -2.80 115.31 116.33 3ito h LEU 309 Ca -0.00 -0.45 -0.12 0.00 0.09 0.00 0.00 57.88 57.40 3ito h LEU 309 Cb 1.15 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 3ito h LEU 309 CO 0.11 0.85 -0.25 0.58 0.09 0.00 0.00 178.44 179.82 3ito h VAL 310 N 0.17 1.27 -0.32 1.22 2.07 -0.74 0.13 116.25 120.06 3ito h VAL 310 Ca 0.04 -1.37 -0.01 0.00 0.82 0.00 0.00 66.70 66.19 3ito h VAL 310 Cb 0.69 1.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 3ito h VAL 310 CO 0.04 0.45 0.16 -0.78 0.02 0.00 0.00 177.57 177.46 3ito h ASP 311 N 0.64 0.39 0.27 0.57 1.82 -1.36 -0.08 116.42 118.66 3ito h ASP 311 Ca 0.08 -0.03 -0.34 0.00 -0.39 0.00 0.00 57.03 56.36 3ito h ASP 311 Cb 0.76 -0.10 0.03 0.00 0.68 0.00 0.00 39.33 40.70 3ito h ASP 311 CO 0.06 0.33 -1.54 0.00 -1.61 0.00 0.00 179.24 176.48 3ito h ALA 312 N 1.73 -0.06 -0.23 -0.78 0.00 -1.17 -3.29 119.26 115.47 3ito h ALA 312 Ca 0.11 -0.94 -0.02 0.00 0.00 0.00 0.00 54.91 54.06 3ito h ALA 312 Cb 0.04 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3ito h ALA 312 CO -0.02 0.80 0.03 1.49 0.00 0.00 0.00 179.25 181.56 3ito h GLU 313 N 0.13 0.33 -0.53 0.00 4.81 -0.24 0.79 114.58 119.87 3ito h GLU 313 Ca -0.27 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.85 3ito h GLU 313 Cb 2.14 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 31.44 3ito h GLU 313 CO 0.25 0.33 0.09 0.00 -0.73 0.00 0.00 179.01 178.94 3ito h ALA 314 N 1.72 0.70 0.00 2.92 0.00 -1.11 -3.14 119.26 120.35 3ito h ALA 314 Ca 0.08 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 3ito h ALA 314 Cb 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3ito h ALA 314 CO 0.00 0.44 -1.24 0.54 0.00 0.00 0.00 179.25 178.99 3ito n ARG 315 N -4.38 0.62 -2.49 0.00 1.74 -0.97 -5.02 116.66 106.15 3ito n ARG 315 Ca 0.02 0.13 -0.05 0.00 -0.77 0.00 0.00 57.85 57.18 3ito n ARG 315 Cb 0.26 -1.79 0.01 0.00 -1.02 0.00 0.00 32.46 29.91 3ito n ARG 315 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ito n GLY 316 N 1.27 -1.11 3.79 -0.13 0.00 0.27 -4.97 105.19 104.30 3ito n GLY 316 Ca -0.04 0.78 -0.36 0.00 0.00 0.00 0.00 46.02 46.40 3ito n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ito s VAL 317 N -2.30 3.98 0.15 1.61 1.01 -1.19 -4.98 120.40 118.69 3ito s VAL 317 Ca 0.15 1.46 -0.33 0.00 0.00 0.00 0.00 61.98 63.26 3ito s VAL 317 Cb -0.04 -3.73 -0.13 0.00 0.00 0.00 0.00 36.38 32.48 3ito s VAL 317 CO 0.55 -0.05 1.66 1.17 0.00 0.00 0.00 175.10 178.43 3ito n LYS 318 N -0.11 2.36 -1.01 2.72 4.81 -1.26 -1.32 118.16 124.34 3ito n LYS 318 Ca 0.05 0.85 -0.00 0.00 -0.87 0.00 0.00 58.31 58.34 3ito n LYS 318 Cb 0.51 -2.65 -0.00 0.00 0.02 0.00 0.00 35.03 32.90 3ito n LYS 318 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ito n GLY 319 N 3.68 0.45 3.28 3.14 0.00 -1.26 -4.59 105.19 109.90 3ito n GLY 319 Ca 0.17 -0.12 -0.45 0.00 0.00 0.00 0.00 46.02 45.63 3ito n GLY 319 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3ito s PHE 320 N -1.88 3.35 -0.44 1.61 5.36 -0.44 -4.73 117.98 120.82 3ito s PHE 320 Ca 0.00 -1.54 0.08 0.00 -0.96 0.00 0.00 56.93 54.51 3ito s PHE 320 Cb 0.00 -3.71 0.32 0.00 -0.34 0.00 0.00 43.02 39.29 3ito s PHE 320 CO 0.00 -1.01 1.00 0.72 -1.46 0.00 0.00 175.22 174.47 3ito n HIS 321 N 5.01 -2.02 -1.52 10.12 8.25 -1.26 -4.75 115.22 129.04 3ito n HIS 321 Ca -0.09 -2.60 -0.44 0.00 -0.26 0.00 0.00 57.72 54.32 3ito n HIS 321 Cb 0.41 1.04 -0.01 0.00 1.12 0.00 0.00 29.99 32.55 3ito n HIS 321 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3ito n PRO 322 N 0.40 0.92 -3.63 -0.41 -0.02 -1.26 -4.96 135.00 126.05 3ito n PRO 322 Ca 0.12 0.33 -0.39 0.00 -2.02 0.00 0.00 63.50 61.54 3ito n PRO 322 Cb 0.68 -1.63 -0.08 0.00 -0.02 0.00 0.00 33.50 32.46 3ito n PRO 322 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ito s ALA 323 N -1.17 3.74 0.19 3.55 0.00 -0.03 -4.94 121.76 123.10 3ito s ALA 323 Ca 0.61 -3.33 -0.30 0.00 0.00 0.00 0.00 51.96 48.94 3ito s ALA 323 Cb -0.71 -2.87 -0.08 0.00 0.00 0.00 0.00 23.12 19.47 3ito s ALA 323 CO 0.59 -2.15 0.96 -1.01 0.00 0.00 0.00 175.76 174.14 3ito s HIS 324 N -0.13 3.90 0.02 0.00 3.76 -1.26 -3.82 115.29 117.76 3ito s HIS 324 Ca 0.18 1.86 -0.08 0.00 -0.15 0.00 0.00 55.06 56.87 3ito s HIS 324 Cb -0.17 -3.02 -0.00 0.00 1.11 0.00 0.00 32.58 30.49 3ito s HIS 324 CO -0.05 0.31 0.15 1.41 -0.85 0.00 0.00 174.74 175.71 3ito s MET 325 N -0.67 0.58 -0.08 1.40 1.75 -1.03 -0.93 119.30 120.31 3ito s MET 325 Ca 0.44 -0.55 -0.14 0.00 -1.25 0.00 0.00 55.69 54.19 3ito s MET 325 Cb -0.25 0.24 -0.05 0.00 2.84 0.00 0.00 34.83 37.61 3ito s MET 325 CO 0.31 -0.15 0.35 0.42 -0.65 0.00 0.00 175.02 175.30 3ito s ILE 326 N -2.04 5.20 -0.34 10.11 1.01 0.30 -0.81 121.20 134.62 3ito s ILE 326 Ca -0.09 0.68 -0.01 0.00 0.00 0.00 0.00 60.65 61.23 3ito s ILE 326 Cb -0.04 -3.66 0.13 0.00 0.01 0.00 0.00 42.46 38.90 3ito s ILE 326 CO -0.01 0.49 0.19 0.21 0.00 0.00 0.00 174.94 175.82 3ito s ASN 327 N -0.33 3.16 0.28 3.58 2.47 -0.58 -3.71 114.94 119.82 3ito s ASN 327 Ca 0.21 -2.02 0.02 0.00 0.42 0.00 0.00 52.86 51.48 3ito s ASN 327 Cb -0.15 -0.45 -0.05 0.00 -1.45 0.00 0.00 41.25 39.16 3ito s ASN 327 CO 0.09 -0.34 0.10 -1.10 -3.72 0.00 0.00 177.10 172.13 3ito s GLN 328 N 1.24 1.51 -0.10 0.43 -0.21 -1.26 -4.57 119.66 116.70 3ito s GLN 328 Ca 0.16 -1.83 0.01 0.00 0.02 0.00 0.00 55.36 53.72 3ito s GLN 328 Cb -0.22 -0.35 0.02 0.00 1.00 0.00 0.00 33.01 33.46 3ito s GLN 328 CO -0.07 -0.31 -0.12 0.45 -2.12 0.00 0.00 175.29 173.11 3ito s SER 329 N -3.37 2.16 -0.61 5.90 0.15 0.02 -4.74 113.70 113.22 3ito s SER 329 Ca 0.37 -0.36 -0.07 0.00 0.70 0.00 0.00 55.95 56.59 3ito s SER 329 Cb 0.07 -0.95 0.16 0.00 -1.71 0.00 0.00 66.02 63.60 3ito s SER 329 CO 0.15 -0.01 0.46 -1.00 1.20 0.00 0.00 173.24 174.04 3ito s HIS 330 N 1.07 3.50 -0.20 3.44 0.09 -1.26 -4.61 115.29 117.31 3ito s HIS 330 Ca -0.06 -2.34 0.20 0.00 -0.00 0.00 0.00 55.06 52.86 3ito s HIS 330 Cb -0.15 -3.40 -0.02 0.00 -0.00 0.00 0.00 32.58 29.02 3ito s HIS 330 CO -0.02 -0.92 1.04 -0.91 -0.00 0.00 0.00 174.74 173.93 3ito h ASN 331 N 7.61 0.00 0.00 1.40 2.35 -1.94 -0.55 115.58 124.46 3ito h ASN 331 Ca -0.05 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.62 3ito h ASN 331 Cb 1.01 0.00 -0.18 0.00 0.05 0.00 0.00 38.32 39.19 3ito h ASN 331 CO 0.76 0.25 -0.71 1.33 -1.65 0.00 0.00 177.43 177.40 3ito n VAL 332 N -2.83 0.39 -4.13 2.81 0.24 -1.26 -4.74 118.33 108.81 3ito n VAL 332 Ca -0.03 -1.00 -0.11 0.00 -2.04 0.00 0.00 64.34 61.15 3ito n VAL 332 Cb 0.67 0.60 -0.08 0.00 -1.47 0.00 0.00 33.84 33.55 3ito n VAL 332 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3ito s THR 333 N -0.58 0.00 -0.20 3.34 -4.23 -1.26 -5.10 115.64 107.61 3ito s THR 333 Ca 0.23 -1.77 -0.29 0.00 -1.18 0.00 0.00 61.69 58.67 3ito s THR 333 Cb 0.25 -2.40 -0.01 0.00 1.34 0.00 0.00 72.50 71.67 3ito s THR 333 CO -0.09 0.00 1.34 -0.62 -0.54 0.00 0.00 174.62 174.71 3ito s ASP 334 N -3.12 6.79 0.24 3.99 -1.08 -1.26 -4.90 116.67 117.33 3ito s ASP 334 Ca 0.33 1.60 -0.08 0.00 -0.52 0.00 0.00 52.55 53.87 3ito s ASP 334 Cb 0.04 -2.54 0.40 0.00 -1.46 0.00 0.00 42.92 39.36 3ito s ASP 334 CO 0.12 -0.91 1.64 -0.65 0.52 0.00 0.00 175.17 175.89 3ito h PRO 335 N 8.85 0.10 -0.55 4.34 0.11 -1.87 -1.16 132.00 141.82 3ito h PRO 335 Ca -0.28 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.86 3ito h PRO 335 Cb 1.11 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 3ito h PRO 335 CO 0.99 0.07 0.30 0.82 -0.21 0.00 0.00 178.00 179.97 3ito h ILE 336 N 0.10 1.00 -0.58 4.15 2.04 -1.87 0.05 117.51 122.40 3ito h ILE 336 Ca 0.39 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 66.00 3ito h ILE 336 Cb 0.67 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 3ito h ILE 336 CO -0.63 0.11 0.17 -0.33 0.00 0.00 0.00 178.15 177.47 3ito h GLU 337 N 0.59 0.91 -0.44 2.37 5.08 -1.65 -0.38 114.58 121.06 3ito h GLU 337 Ca 0.24 -0.20 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 3ito h GLU 337 Cb 0.10 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 3ito h GLU 337 CO -0.14 0.82 0.08 0.77 -1.00 0.00 0.00 179.01 179.54 3ito h SER 338 N 0.82 0.69 -0.68 1.42 0.02 -0.91 -1.60 113.55 113.30 3ito h SER 338 Ca 0.19 -0.25 -0.03 0.00 -0.84 0.00 0.00 61.79 60.85 3ito h SER 338 Cb 0.30 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 3ito h SER 338 CO -0.00 0.76 0.30 -0.07 -1.14 0.00 0.00 176.83 176.68 3ito h LEU 339 N 0.58 0.94 0.28 5.07 3.38 -0.81 0.11 115.31 124.85 3ito h LEU 339 Ca 0.13 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3ito h LEU 339 Cb 0.36 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3ito h LEU 339 CO 0.01 0.82 -0.13 0.40 0.09 0.00 0.00 178.44 179.62 3ito h ILE 340 N 1.01 0.74 0.00 1.22 2.04 -0.76 -1.05 117.51 120.70 3ito h ILE 340 Ca 0.24 -0.05 -0.04 0.00 1.00 0.00 0.00 64.86 66.00 3ito h ILE 340 Cb 0.16 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3ito h ILE 340 CO -0.02 0.01 -0.21 0.78 0.00 0.00 0.00 178.15 178.71 3ito h ASN 341 N -0.40 0.00 -0.11 1.72 4.21 -1.06 -1.78 115.58 118.16 3ito h ASN 341 Ca -0.04 0.00 -0.20 0.00 1.21 0.00 0.00 56.30 57.27 3ito h ASN 341 Cb 0.30 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.52 3ito h ASN 341 CO 0.06 0.21 -0.73 0.28 -1.29 0.00 0.00 177.43 175.97 3ito h SER 342 N 0.00 0.83 -0.25 5.81 0.02 -0.59 -0.81 113.55 118.57 3ito h SER 342 Ca -0.00 -0.66 -0.06 0.00 -0.84 0.00 0.00 61.79 60.23 3ito h SER 342 Cb 0.69 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 3ito h SER 342 CO 0.03 1.36 -0.04 0.00 -1.14 0.00 0.00 176.83 177.04 3ito h ALA 343 N 0.49 1.26 -0.34 3.77 0.00 -0.99 -1.50 119.26 121.96 3ito h ALA 343 Ca -0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 3ito h ALA 343 Cb 1.37 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3ito h ALA 343 CO 0.15 0.49 0.13 -0.91 0.00 0.00 0.00 179.25 179.11 3ito h ASN 344 N 0.55 0.47 -0.36 0.00 -0.26 -1.14 -1.81 115.58 113.05 3ito h ASN 344 Ca 0.11 -0.17 -0.04 0.00 -0.56 0.00 0.00 56.30 55.64 3ito h ASN 344 Cb 0.41 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 37.53 3ito h ASN 344 CO 0.02 0.52 0.10 -0.33 -1.06 0.00 0.00 177.43 176.68 3ito h GLU 345 N 0.40 0.64 -0.44 0.81 4.39 -0.59 0.94 114.58 120.72 3ito h GLU 345 Ca 0.11 -0.11 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 3ito h GLU 345 Cb 0.20 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.73 3ito h GLU 345 CO -0.01 0.59 0.00 0.82 -1.16 0.00 0.00 179.01 179.25 3ito h ILE 346 N 0.62 1.26 0.00 3.13 2.04 -1.03 -1.18 117.51 122.36 3ito h ILE 346 Ca 0.14 -1.03 -0.11 0.00 1.00 0.00 0.00 64.86 64.86 3ito h ILE 346 Cb 0.24 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3ito h ILE 346 CO -0.00 0.36 -0.53 0.03 0.00 0.00 0.00 178.15 178.00 3ito h ARG 347 N 0.62 0.00 -0.16 2.37 3.08 -0.86 -2.06 114.38 117.38 3ito h ARG 347 Ca 0.13 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 3ito h ARG 347 Cb 0.49 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 3ito h ARG 347 CO 0.02 0.53 0.01 -0.09 -1.07 0.00 0.00 179.97 179.38 3ito h ARG 348 N 0.00 0.27 -0.66 0.04 2.43 -0.49 0.32 114.38 116.29 3ito h ARG 348 Ca -0.01 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 3ito h ARG 348 Cb 0.99 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.48 3ito h ARG 348 CO 0.07 0.47 0.09 0.00 -1.51 0.00 0.00 179.97 179.09 3ito h ALA 349 N 0.79 0.92 -0.41 2.80 0.00 -1.16 -1.28 119.26 120.93 3ito h ALA 349 Ca 0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 3ito h ALA 349 Cb 0.34 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3ito h ALA 349 CO 0.01 0.67 0.22 -0.92 0.00 0.00 0.00 179.25 179.22 3ito h TYR 350 N 1.02 0.56 -0.42 0.00 3.20 -1.25 -0.97 116.97 119.11 3ito h TYR 350 Ca 0.20 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.05 3ito h TYR 350 Cb 0.45 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 3ito h TYR 350 CO 0.03 0.44 0.26 0.00 -1.64 0.00 0.00 178.16 177.25 3ito h ALA 351 N 1.07 0.54 -0.41 1.82 0.00 -0.65 -1.38 119.26 120.25 3ito h ALA 351 Ca 0.14 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 3ito h ALA 351 Cb 0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3ito h ALA 351 CO -0.02 0.02 -0.09 1.96 0.00 0.00 0.00 179.25 181.12 3ito h GLN 352 N 0.56 0.71 -0.28 0.00 4.20 -1.07 -1.88 115.11 117.35 3ito h GLN 352 Ca 0.15 -0.22 -0.07 0.00 0.06 0.00 0.00 58.65 58.57 3ito h GLN 352 Cb -0.01 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 3ito h GLN 352 CO -0.03 0.79 -0.13 0.00 -0.67 0.00 0.00 178.83 178.79 3ito h ALA 353 N 1.25 1.25 0.00 3.87 0.00 -0.88 -1.26 119.26 123.49 3ito h ALA 353 Ca 0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3ito h ALA 353 Cb 0.54 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3ito h ALA 353 CO 0.03 0.49 -0.05 -0.07 0.00 0.00 0.00 179.25 179.65 3ito h LEU 354 N 0.44 0.00 0.00 0.00 4.07 -0.44 -2.43 115.31 116.95 3ito h LEU 354 Ca 0.08 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.04 3ito h LEU 354 Cb 0.50 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.24 3ito h LEU 354 CO 0.03 0.05 -0.25 0.18 -1.08 0.00 0.00 178.44 177.37 3ito n LEU 355 N -3.43 0.38 -4.72 1.67 4.77 -0.48 -4.90 117.00 110.30 3ito n LEU 355 Ca -0.02 0.32 -0.42 0.00 -0.03 0.00 0.00 56.01 55.86 3ito n LEU 355 Cb 0.18 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 3ito n LEU 355 CO 0.27 0.00 1.32 -0.69 -1.33 0.00 0.00 177.39 176.96 3ito s VAL 356 N -3.04 2.25 -0.93 4.08 1.01 -0.92 -4.78 120.40 118.07 3ito s VAL 356 Ca 0.11 0.18 -0.24 0.00 0.00 0.00 0.00 61.98 62.03 3ito s VAL 356 Cb 0.17 -3.12 0.05 0.00 0.00 0.00 0.00 36.38 33.48 3ito s VAL 356 CO 0.62 0.01 1.39 -0.62 0.00 0.00 0.00 175.10 176.50 3ito s ASP 357 N 1.15 6.40 0.27 3.32 -1.08 -1.26 -4.85 116.67 120.63 3ito s ASP 357 Ca 0.73 -1.18 -0.03 0.00 -0.52 0.00 0.00 52.55 51.55 3ito s ASP 357 Cb -0.47 -2.56 0.38 0.00 -1.46 0.00 0.00 42.92 38.81 3ito s ASP 357 CO 0.32 -1.59 1.93 0.03 0.52 0.00 0.00 175.17 176.38 3ito h ARG 358 N 9.83 1.18 -0.07 4.34 2.47 -1.96 -0.15 114.38 130.02 3ito h ARG 358 Ca 0.06 -0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 58.70 3ito h ARG 358 Cb 1.02 -0.27 -0.00 0.00 -1.65 0.00 0.00 29.97 29.07 3ito h ARG 358 CO 1.37 0.78 0.03 0.00 0.56 0.00 0.00 179.97 182.72 3ito h ALA 359 N 1.44 0.09 -0.49 0.04 0.00 -1.99 0.13 119.26 118.47 3ito h ALA 359 Ca 0.37 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 3ito h ALA 359 Cb -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3ito h ALA 359 CO -0.11 -0.37 0.19 0.00 0.00 0.00 0.00 179.25 178.96 3ito h ALA 360 N 0.93 0.64 0.00 0.00 0.00 -1.91 -1.76 119.26 117.17 3ito h ALA 360 Ca 0.02 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.79 3ito h ALA 360 Cb 0.10 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3ito h ALA 360 CO -0.00 0.26 -0.08 1.25 0.00 0.00 0.00 179.25 180.68 3ito h LEU 361 N 0.66 -0.24 -0.93 0.00 5.85 -0.81 -1.04 115.31 118.79 3ito h LEU 361 Ca 0.16 0.04 0.10 0.00 0.84 0.00 0.00 57.88 59.02 3ito h LEU 361 Cb 0.21 0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.27 3ito h LEU 361 CO -0.01 -0.12 0.57 -1.28 -0.34 0.00 0.00 178.44 177.26 3ito h SER 362 N -0.15 0.84 0.22 1.25 0.87 -0.59 -0.61 113.55 115.39 3ito h SER 362 Ca 0.03 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 3ito h SER 362 Cb 0.19 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 3ito h SER 362 CO -0.08 0.47 -0.11 1.23 -0.53 0.00 0.00 176.83 177.81 3ito h GLY 363 N 0.94 -0.31 2.00 5.77 0.00 -0.64 -1.54 103.07 109.28 3ito h GLY 363 Ca 0.45 0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.87 3ito h GLY 363 CO -0.24 -0.11 -0.09 -0.97 0.00 0.00 0.00 176.54 175.12 3ito h TYR 364 N -0.37 0.00 -0.12 5.60 0.05 -0.62 -1.64 116.97 119.87 3ito h TYR 364 Ca -0.03 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.63 3ito h TYR 364 Cb 0.29 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.03 3ito h TYR 364 CO -0.04 0.09 -0.39 1.96 -1.05 0.00 0.00 178.16 178.73 3ito h GLN 365 N 0.00 0.48 -0.23 4.88 4.20 -0.86 0.01 115.11 123.58 3ito h GLN 365 Ca -0.00 -0.35 -0.06 0.00 0.06 0.00 0.00 58.65 58.30 3ito h GLN 365 Cb 0.19 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 3ito h GLN 365 CO 0.01 0.97 -0.12 0.93 -0.67 0.00 0.00 178.83 179.96 3ito h GLU 366 N 0.08 0.38 -0.01 1.46 4.39 -0.74 -2.44 114.58 117.69 3ito h GLU 366 Ca -0.01 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.59 3ito h GLU 366 Cb 1.01 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 3ito h GLU 366 CO 0.08 0.51 -0.03 -0.25 -1.16 0.00 0.00 179.01 178.16 3ito n ASP 367 N -4.24 1.21 -3.34 1.42 10.43 -0.67 -4.93 116.55 116.44 3ito n ASP 367 Ca 0.00 -1.34 -0.24 0.00 2.57 0.00 0.00 54.79 55.78 3ito n ASP 367 Cb 0.29 0.01 0.05 0.00 1.84 0.00 0.00 41.12 43.31 3ito n ASP 367 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3ito n ASN 368 N -0.10 -6.05 -4.30 -2.24 4.13 -0.89 -4.90 115.26 100.91 3ito n ASN 368 Ca 0.19 -0.43 -0.44 0.00 1.68 0.00 0.00 54.58 55.57 3ito n ASN 368 Cb 0.32 -4.83 0.00 0.00 -1.54 0.00 0.00 39.78 33.73 3ito n ASN 368 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 3ito n ASP 369 N -2.74 5.52 -0.31 6.41 4.64 -0.06 -4.86 116.55 125.14 3ito n ASP 369 Ca -0.05 -3.07 0.03 0.00 -1.38 0.00 0.00 54.79 50.32 3ito n ASP 369 Cb 0.59 -1.43 0.17 0.00 -1.04 0.00 0.00 41.12 39.41 3ito n ASP 369 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3ito h ALA 370 N 6.57 1.25 0.12 -1.67 0.00 -1.91 -1.01 119.26 122.62 3ito h ALA 370 Ca 0.24 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3ito h ALA 370 Cb 0.82 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3ito h ALA 370 CO 1.17 0.19 -0.06 1.25 0.00 0.00 0.00 179.25 181.80 3ito h LEU 371 N 0.90 -0.14 -1.02 0.00 5.85 -1.96 -1.22 115.31 117.72 3ito h LEU 371 Ca 0.41 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 59.08 3ito h LEU 371 Cb 0.33 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 3ito h LEU 371 CO -0.23 -0.10 -0.30 0.24 -0.34 0.00 0.00 178.44 177.71 3ito h MET 372 N -0.16 0.00 -0.02 1.25 2.86 -1.92 -1.26 114.93 115.69 3ito h MET 372 Ca -0.01 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3ito h MET 372 Cb 0.13 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 3ito h MET 372 CO 0.02 0.30 -0.00 0.00 1.06 0.00 0.00 176.91 178.29 3ito h ALA 373 N 1.70 0.02 -0.16 6.32 0.00 -0.84 -0.53 119.26 125.77 3ito h ALA 373 Ca -0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 3ito h ALA 373 Cb 0.82 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3ito h ALA 373 CO 0.04 -0.31 -0.32 0.00 0.00 0.00 0.00 179.25 178.66 3ito h THR 374 N -0.28 1.27 -0.13 0.00 1.03 -1.10 -2.41 112.91 111.29 3ito h THR 374 Ca 0.00 -1.32 -0.10 0.00 -0.01 0.00 0.00 66.41 64.98 3ito h THR 374 Cb 0.33 1.51 -0.01 0.00 -1.07 0.00 0.00 68.15 68.91 3ito h THR 374 CO 0.00 0.40 -0.38 -0.08 -0.01 0.00 0.00 175.52 175.45 3ito h GLU 375 N 0.27 0.28 -0.43 0.00 4.57 -1.12 -1.13 114.58 117.03 3ito h GLU 375 Ca 0.04 -0.13 -0.06 0.00 -1.18 0.00 0.00 59.36 58.03 3ito h GLU 375 Cb 0.70 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.26 3ito h GLU 375 CO 0.05 0.62 0.00 1.15 -1.18 0.00 0.00 179.01 179.66 3ito h THR 376 N 0.24 1.23 -0.15 0.32 2.02 -0.59 0.11 112.91 116.08 3ito h THR 376 Ca 0.02 -0.92 -0.17 0.00 0.77 0.00 0.00 66.41 66.11 3ito h THR 376 Cb 0.78 0.90 0.01 0.00 -1.74 0.00 0.00 68.15 68.10 3ito h THR 376 CO 0.06 0.32 -0.58 -0.07 0.37 0.00 0.00 175.52 175.63 3ito h LEU 377 N 0.65 0.77 -1.01 2.58 3.38 -1.23 -3.24 115.31 117.21 3ito h LEU 377 Ca 0.13 -0.61 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 3ito h LEU 377 Cb 0.40 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 3ito h LEU 377 CO 0.02 1.25 0.31 0.11 0.09 0.00 0.00 178.44 180.21 3ito h LYS 378 N 0.33 1.01 -0.35 1.13 1.79 -0.76 -0.41 116.57 119.32 3ito h LYS 378 Ca -0.03 -0.15 0.06 0.00 -2.18 0.00 0.00 60.65 58.34 3ito h LYS 378 Cb 1.20 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 31.66 3ito h LYS 378 CO 0.12 0.80 0.24 0.00 -1.08 0.00 0.00 179.45 179.53 3ito h ARG 379 N 1.00 0.22 0.06 3.15 3.08 -0.82 0.87 114.38 121.94 3ito h ARG 379 Ca 0.24 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 60.18 3ito h ARG 379 Cb 0.15 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.15 3ito h ARG 379 CO -0.03 0.15 -0.46 0.00 -1.07 0.00 0.00 179.97 178.56 3ito h ALA 380 N 1.81 -0.01 -0.80 0.04 0.00 -1.42 -3.31 119.26 115.57 3ito h ALA 380 Ca 0.15 -0.65 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 3ito h ALA 380 Cb 0.33 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 3ito h ALA 380 CO -0.03 0.23 0.36 -0.92 0.00 0.00 0.00 179.25 178.89 3ito h TYR 381 N -0.72 1.19 0.00 0.00 3.20 -0.34 -2.59 116.97 117.71 3ito h TYR 381 Ca -0.09 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.71 3ito h TYR 381 Cb 1.31 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 39.21 3ito h TYR 381 CO 0.23 0.88 0.00 0.00 -1.64 0.00 0.00 178.16 177.63 3ito h ARG 382 N 1.15 0.00 -6.39 1.82 3.08 0.59 -3.44 114.38 111.19 3ito h ARG 382 Ca 0.27 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.78 3ito h ARG 382 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 3ito h ARG 382 CO -0.03 0.00 0.82 0.99 -1.07 0.00 0.00 179.97 180.68 3ito s THR 383 N -3.44 3.68 -0.76 2.04 2.01 -0.98 -4.95 115.64 113.24 3ito s THR 383 Ca 0.02 1.09 -0.26 0.00 0.31 0.00 0.00 61.69 62.85 3ito s THR 383 Cb 0.09 -3.70 0.04 0.00 0.01 0.00 0.00 72.50 68.94 3ito s THR 383 CO 0.36 0.01 1.26 -0.62 -0.69 0.00 0.00 174.62 174.94 3ito s ASP 384 N 1.81 6.20 -0.01 3.53 -1.08 -1.26 -4.85 116.67 121.00 3ito s ASP 384 Ca 0.64 -0.64 0.10 0.00 -0.52 0.00 0.00 52.55 52.13 3ito s ASP 384 Cb -0.32 -2.54 0.32 0.00 -1.46 0.00 0.00 42.92 38.92 3ito s ASP 384 CO 0.27 -1.75 1.23 1.33 0.52 0.00 0.00 175.17 176.77 3ito n VAL 385 N 6.38 0.58 -0.36 1.11 0.24 -1.26 -4.37 118.33 120.64 3ito n VAL 385 Ca 0.06 -0.49 0.08 0.00 -2.04 0.00 0.00 64.34 61.95 3ito n VAL 385 Cb 0.49 0.15 0.25 0.00 -1.47 0.00 0.00 33.84 33.26 3ito n VAL 385 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3ito h GLU 386 N 2.02 0.92 -0.22 7.34 4.57 -1.98 0.66 114.58 127.89 3ito h GLU 386 Ca 0.00 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.13 3ito h GLU 386 Cb 0.56 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 3ito h GLU 386 CO 0.03 0.61 0.15 -1.35 -1.18 0.00 0.00 179.01 177.27 3ito h PRO 387 N 0.95 0.26 -0.13 0.92 0.11 -1.93 0.59 132.00 132.78 3ito h PRO 387 Ca 0.51 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 66.47 3ito h PRO 387 Cb 0.56 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.61 3ito h PRO 387 CO -0.29 0.17 -0.42 0.82 -0.21 0.00 0.00 178.00 178.08 3ito h ILE 388 N 0.27 1.36 -0.69 4.15 2.04 -1.22 -1.74 117.51 121.68 3ito h ILE 388 Ca 0.09 -1.71 -0.08 0.00 1.00 0.00 0.00 64.86 64.15 3ito h ILE 388 Cb 0.02 2.08 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 3ito h ILE 388 CO -0.02 0.52 0.13 -0.07 0.00 0.00 0.00 178.15 178.71 3ito h LEU 389 N 0.13 1.07 -0.47 1.44 3.38 -0.68 -1.32 115.31 118.86 3ito h LEU 389 Ca -0.02 -0.25 -0.14 0.00 0.09 0.00 0.00 57.88 57.57 3ito h LEU 389 Cb 1.04 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 3ito h LEU 389 CO 0.09 1.05 -0.24 0.00 0.09 0.00 0.00 178.44 179.43 3ito h ALA 390 N 1.06 0.66 -0.37 1.53 0.00 -0.92 -2.42 119.26 118.81 3ito h ALA 390 Ca 0.21 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 3ito h ALA 390 Cb 0.42 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3ito h ALA 390 CO 0.01 0.67 -0.32 1.49 0.00 0.00 0.00 179.25 181.09 3ito h GLU 391 N 0.84 0.88 -0.83 0.00 4.57 -1.21 -0.71 114.58 118.12 3ito h GLU 391 Ca 0.10 -0.45 0.06 0.00 -1.18 0.00 0.00 59.36 57.89 3ito h GLU 391 Cb 0.82 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 29.36 3ito h GLU 391 CO 0.07 1.09 0.51 0.00 -1.18 0.00 0.00 179.01 179.51 3ito h ALA 392 N 0.77 1.13 -0.29 2.92 0.00 -1.20 0.70 119.26 123.29 3ito h ALA 392 Ca 0.06 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3ito h ALA 392 Cb 0.91 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3ito h ALA 392 CO 0.08 0.26 -0.11 0.00 0.00 0.00 0.00 179.25 179.49 3ito h ARG 393 N 0.95 0.59 -0.83 0.00 3.08 -1.24 -2.53 114.38 114.40 3ito h ARG 393 Ca 0.36 -0.24 0.02 0.00 0.07 0.00 0.00 59.98 60.19 3ito h ARG 393 Cb 0.15 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.13 3ito h ARG 393 CO -0.16 0.80 0.54 -0.09 -1.07 0.00 0.00 179.97 179.99 3ito h ARG 394 N 0.34 1.03 0.00 0.04 2.43 -0.29 0.62 114.38 118.55 3ito h ARG 394 Ca 0.07 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 3ito h ARG 394 Cb 0.61 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.92 3ito h ARG 394 CO 0.04 0.68 -0.05 0.00 -1.51 0.00 0.00 179.97 179.13 3ito h ARG 395 N 1.06 0.00 -0.53 0.20 3.08 -0.86 -3.26 114.38 114.09 3ito h ARG 395 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 3ito h ARG 395 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 3ito h ARG 395 CO -0.10 0.05 0.00 0.25 -1.07 0.00 0.00 179.97 179.10 3ito n THR 396 N -3.13 1.29 -0.29 2.04 -2.24 -0.88 -4.94 114.28 106.12 3ito n THR 396 Ca 0.02 -1.12 0.00 0.00 -2.27 0.00 0.00 64.05 60.68 3ito n THR 396 Cb 0.41 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 3ito n THR 396 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ito n GLY 397 N 0.91 0.83 0.54 3.38 0.00 -1.01 -4.98 105.19 104.85 3ito n GLY 397 Ca 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.19 3ito n GLY 397 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ito n GLY 398 N -2.25 1.34 3.81 -0.02 0.00 0.21 -4.80 105.19 103.49 3ito n GLY 398 Ca 0.00 -2.05 -0.34 0.00 0.00 0.00 0.00 46.02 43.63 3ito n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ito s ALA 399 N -2.46 3.67 0.11 4.61 0.00 -0.48 -4.23 121.76 122.98 3ito s ALA 399 Ca 0.09 -0.80 -0.21 0.00 0.00 0.00 0.00 51.96 51.04 3ito s ALA 399 Cb -0.01 -1.70 -0.09 0.00 0.00 0.00 0.00 23.12 21.33 3ito s ALA 399 CO 0.06 0.67 1.74 0.28 0.00 0.00 0.00 175.76 178.52 3ito h VAL 400 N 3.41 0.97 -3.36 0.00 2.07 -1.87 -3.33 116.25 114.14 3ito h VAL 400 Ca -0.50 -0.03 -0.64 0.00 0.82 0.00 0.00 66.70 66.35 3ito h VAL 400 Cb 1.19 0.87 -0.41 0.00 -1.52 0.00 0.00 31.29 31.43 3ito h VAL 400 CO 0.62 0.02 -0.68 -0.62 0.02 0.00 0.00 177.57 176.92 3ito s ASP 401 N -5.25 4.28 0.13 0.57 -1.08 -1.26 -4.67 116.67 109.38 3ito s ASP 401 Ca -0.13 -2.65 -0.31 0.00 -0.52 0.00 0.00 52.55 48.94 3ito s ASP 401 Cb 0.08 -1.47 -0.08 0.00 -1.46 0.00 0.00 42.92 39.99 3ito s ASP 401 CO 0.68 -0.29 1.56 -0.65 0.52 0.00 0.00 175.17 177.00 3ito h PRO 402 N 6.91 -0.45 -0.91 4.34 0.11 -1.86 -0.79 132.00 139.35 3ito h PRO 402 Ca -0.06 0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.08 3ito h PRO 402 Cb 0.94 0.10 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 3ito h PRO 402 CO 0.60 -0.30 0.59 0.28 -0.21 0.00 0.00 178.00 178.95 3ito h VAL 403 N -0.47 1.24 -0.55 3.15 2.07 -1.95 0.33 116.25 120.06 3ito h VAL 403 Ca 0.08 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.12 3ito h VAL 403 Cb 0.63 -0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3ito h VAL 403 CO -0.49 0.24 0.27 0.00 0.02 0.00 0.00 177.57 177.60 3ito h ALA 404 N 1.32 0.71 -0.46 1.67 0.00 -1.91 -0.21 119.26 120.38 3ito h ALA 404 Ca 0.33 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 3ito h ALA 404 Cb -0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 3ito h ALA 404 CO -0.07 0.28 -0.19 1.15 0.00 0.00 0.00 179.25 180.42 3ito h THR 405 N 0.75 1.27 -0.46 0.00 2.02 -0.63 -1.22 112.91 114.64 3ito h THR 405 Ca 0.19 -1.33 0.01 0.00 0.77 0.00 0.00 66.41 66.06 3ito h THR 405 Cb 0.12 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 3ito h THR 405 CO -0.02 0.46 0.29 0.22 0.37 0.00 0.00 175.52 176.83 3ito h TYR 406 N 0.80 0.54 -0.15 3.16 3.20 0.08 -1.39 116.97 123.21 3ito h TYR 406 Ca 0.11 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.86 3ito h TYR 406 Cb 0.74 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 3ito h TYR 406 CO 0.04 0.32 -0.50 0.00 -1.64 0.00 0.00 178.16 176.39 3ito h ARG 407 N 0.58 0.40 -0.00 1.82 3.08 -0.90 -2.93 114.38 116.43 3ito h ARG 407 Ca 0.18 -0.23 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 3ito h ARG 407 Cb -0.02 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3ito h ARG 407 CO -0.06 0.81 -0.39 0.00 -1.07 0.00 0.00 179.97 179.25 3ito h ALA 408 N 1.15 1.35 0.00 0.04 0.00 -0.84 -2.79 119.26 118.16 3ito h ALA 408 Ca 0.01 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 3ito h ALA 408 Cb 0.99 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 3ito h ALA 408 CO 0.09 0.49 -0.23 0.66 0.00 0.00 0.00 179.25 180.26 3ito h SER 409 N 0.01 0.00 -0.75 0.00 4.64 -1.07 -3.47 113.55 112.90 3ito h SER 409 Ca -0.00 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.11 3ito h SER 409 Cb 0.70 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.72 3ito h SER 409 CO 0.05 0.23 -0.21 0.61 -0.87 0.00 0.00 176.83 176.64 3ito n GLY 410 N 0.38 0.86 0.16 -0.77 0.00 -1.06 -4.93 105.19 99.83 3ito n GLY 410 Ca 0.01 -0.53 -0.06 0.00 0.00 0.00 0.00 46.02 45.44 3ito n GLY 410 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3ito h TYR 411 N 0.00 -0.21 -0.75 1.61 3.20 -1.86 -1.33 116.97 117.63 3ito h TYR 411 Ca -0.22 0.03 0.12 0.00 3.14 0.00 0.00 58.73 61.80 3ito h TYR 411 Cb 0.81 0.14 -0.09 0.00 1.54 0.00 0.00 36.73 39.13 3ito h TYR 411 CO 0.29 -0.16 0.34 -0.09 -1.64 0.00 0.00 178.16 176.90 3ito h ARG 412 N -0.02 0.51 -0.45 1.82 9.65 -1.91 0.90 114.38 124.88 3ito h ARG 412 Ca 0.16 -0.03 -0.09 0.00 -1.10 0.00 0.00 59.98 58.92 3ito h ARG 412 Cb 0.26 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.70 3ito h ARG 412 CO -0.34 0.34 -0.08 0.00 2.80 0.00 0.00 179.97 182.69 3ito h ALA 413 N 1.51 1.03 0.37 2.80 0.00 -1.82 -1.52 119.26 121.62 3ito h ALA 413 Ca 0.40 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3ito h ALA 413 Cb 0.54 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3ito h ALA 413 CO -0.35 0.59 -0.20 -0.09 0.00 0.00 0.00 179.25 179.21 3ito h ARG 414 N 0.71 -0.51 0.00 0.00 2.43 0.24 -2.42 114.38 114.84 3ito h ARG 414 Ca 0.13 0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 3ito h ARG 414 Cb 0.55 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 3ito h ARG 414 CO 0.03 -0.34 -0.20 -0.39 -1.51 0.00 0.00 179.97 177.56 3ito h VAL 415 N -0.53 0.60 -0.81 0.20 -1.51 -1.15 -2.45 116.25 110.61 3ito h VAL 415 Ca -0.05 -0.92 -0.04 0.00 -1.23 0.00 0.00 66.70 64.46 3ito h VAL 415 Cb 0.42 1.60 -0.04 0.00 -2.13 0.00 0.00 31.29 31.15 3ito h VAL 415 CO 0.07 0.20 0.35 0.00 -1.23 0.00 0.00 177.57 176.95 3ito h ALA 416 N 1.80 1.07 0.00 5.19 0.00 -0.92 0.11 119.26 126.51 3ito h ALA 416 Ca -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 3ito h ALA 416 Cb 0.59 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3ito h ALA 416 CO 0.03 0.67 -0.07 0.00 0.00 0.00 0.00 179.25 179.87 3ito h ALA 417 N 1.20 0.98 0.00 0.00 0.00 -0.96 -3.20 119.26 117.27 3ito h ALA 417 Ca 0.27 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 3ito h ALA 417 Cb 0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3ito h ALA 417 CO -0.03 0.09 -1.53 0.39 0.00 0.00 0.00 179.25 178.17 3ito n GLU 418 N -3.15 0.63 -4.24 0.00 1.02 -0.89 -4.87 120.64 109.14 3ito n GLU 418 Ca 0.02 0.05 -0.34 0.00 -0.02 0.00 0.00 57.16 56.87 3ito n GLU 418 Cb 0.44 -1.71 -0.15 0.00 -0.02 0.00 0.00 31.44 30.00 3ito n GLU 418 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3ito s ARG 419 N -3.19 3.30 0.04 3.49 0.52 -0.03 -5.10 118.95 118.00 3ito s ARG 419 Ca -0.04 -0.69 -0.30 0.00 -0.52 0.00 0.00 55.73 54.18 3ito s ARG 419 Cb 0.10 -2.80 -0.05 0.00 0.52 0.00 0.00 34.95 32.72 3ito s ARG 419 CO 0.83 -0.06 1.19 -2.14 0.02 0.00 0.00 175.30 175.14 3ito s PRO 420 N 1.06 4.43 0.69 3.54 0.02 -1.26 -4.58 135.00 138.91 3ito s PRO 420 Ca -0.00 1.74 -0.08 0.00 0.02 0.00 0.00 61.00 62.68 3ito s PRO 420 Cb -0.15 -3.38 0.04 0.00 0.02 0.00 0.00 34.50 31.04 3ito s PRO 420 CO -0.02 -0.27 1.02 0.00 -0.33 0.00 0.00 177.00 177.40 3ito s ALA 421 N 1.20 3.07 0.33 -1.55 0.00 -1.26 -4.95 121.76 118.59 3ito s ALA 421 Ca 0.58 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.82 3ito s ALA 421 Cb -0.28 -2.73 0.56 0.00 0.00 0.00 0.00 23.12 20.67 3ito s ALA 421 CO 0.28 -1.21 1.94 0.77 0.00 0.00 0.00 175.76 177.55 3ito h SER 422 N -0.57 0.72 -4.21 0.00 0.02 -1.97 -3.43 113.55 104.10 3ito h SER 422 Ca -0.45 -0.06 -0.18 0.00 -0.84 0.00 0.00 61.79 60.26 3ito h SER 422 Cb 1.29 -0.18 -0.25 0.00 0.14 0.00 0.00 62.40 63.40 3ito h SER 422 CO 0.62 0.60 -0.56 -0.69 -1.14 0.00 0.00 176.83 175.65 3ito s VAL 423 N -5.50 0.03 -1.30 2.27 1.01 -1.26 -5.33 120.40 110.32 3ito s VAL 423 Ca -0.10 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.61 3ito s VAL 423 Cb 0.17 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 36.29 3ito s VAL 423 CO 0.77 -0.15 0.32 0.00 0.00 0.00 0.00 175.10 176.05