#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iuh h ARG 5 N 0.00 0.23 -5.18 -1.08 2.47 -1.92 -3.40 114.38 105.50 3iuh h ARG 5 Ca 0.00 -0.09 -0.65 0.00 -1.26 0.00 0.00 59.98 57.98 3iuh h ARG 5 Cb 0.00 -0.01 -0.26 0.00 -1.65 0.00 0.00 29.97 28.04 3iuh h ARG 5 CO 0.00 0.53 -0.73 0.42 0.56 0.00 0.00 179.97 180.75 3iuh s ILE 6 N -4.35 3.36 0.06 2.04 -1.09 -1.26 -5.02 121.20 114.93 3iuh s ILE 6 Ca -0.05 -0.53 -0.35 0.00 -2.23 0.00 0.00 60.65 57.49 3iuh s ILE 6 Cb 0.14 -2.47 -0.14 0.00 -1.58 0.00 0.00 42.46 38.40 3iuh s ILE 6 CO 0.76 0.48 1.59 0.00 -1.23 0.00 0.00 174.94 176.53 3iuh n ALA 7 N 4.07 0.54 0.23 9.38 0.00 -1.26 -4.85 120.51 128.62 3iuh n ALA 7 Ca -0.18 0.43 0.13 0.00 0.00 0.00 0.00 53.44 53.82 3iuh n ALA 7 Cb 0.52 -2.30 0.76 0.00 0.00 0.00 0.00 19.45 18.43 3iuh n ALA 7 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3iuh h GLN 8 N 6.29 0.00 -0.01 0.00 4.20 -1.98 -1.28 115.11 122.34 3iuh h GLN 8 Ca -0.46 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.12 3iuh h GLN 8 Cb 1.28 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.05 3iuh h GLN 8 CO 0.88 0.00 -0.59 0.38 -0.67 0.00 0.00 178.83 178.82 3iuh h ASP 9 N 0.00 0.04 -0.10 1.46 2.03 -1.99 -0.72 116.42 117.14 3iuh h ASP 9 Ca 0.05 -0.02 -0.12 0.00 -0.73 0.00 0.00 57.03 56.21 3iuh h ASP 9 Cb 0.23 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 38.72 3iuh h ASP 9 CO -0.00 0.62 -0.41 0.58 -1.03 0.00 0.00 179.24 179.01 3iuh h VAL 10 N 0.02 1.39 -0.12 4.15 2.07 -1.61 -1.42 116.25 120.73 3iuh h VAL 10 Ca -0.01 -1.76 0.02 0.00 0.82 0.00 0.00 66.70 65.78 3iuh h VAL 10 Cb 1.06 2.22 -0.02 0.00 -1.52 0.00 0.00 31.29 33.03 3iuh h VAL 10 CO 0.08 0.52 -0.00 0.58 0.02 0.00 0.00 177.57 178.77 3iuh h VAL 11 N 0.01 0.91 -0.33 2.57 2.07 -1.33 0.15 116.25 120.31 3iuh h VAL 11 Ca -0.02 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.51 3iuh h VAL 11 Cb 1.05 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 3iuh h VAL 11 CO 0.09 0.01 0.14 0.00 0.02 0.00 0.00 177.57 177.82 3iuh h ALA 12 N 1.10 0.39 0.27 1.67 0.00 -1.15 -1.05 119.26 120.49 3iuh h ALA 12 Ca 0.06 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3iuh h ALA 12 Cb 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3iuh h ALA 12 CO -0.10 -0.25 -0.18 -0.09 0.00 0.00 0.00 179.25 178.64 3iuh h ARG 13 N 0.30 -0.42 0.00 0.00 2.43 -0.81 -0.73 114.38 115.15 3iuh h ARG 13 Ca 0.14 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 3iuh h ARG 13 Cb 0.09 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 3iuh h ARG 13 CO -0.12 -0.28 0.00 0.39 -1.51 0.00 0.00 179.97 178.44 3iuh n GLU 14 N -5.30 0.10 -0.04 0.20 -0.58 0.49 -1.65 120.64 113.86 3iuh n GLU 14 Ca -0.09 0.40 -0.21 0.00 -0.42 0.00 0.00 57.16 56.84 3iuh n GLU 14 Cb 0.22 -1.72 -0.13 0.00 -0.57 0.00 0.00 31.44 29.23 3iuh n GLU 14 CO 0.00 0.00 0.00 -0.91 -0.48 0.00 0.00 177.13 175.74 3iuh h ASN 15 N 0.00 0.22 -0.77 1.62 2.35 -0.69 -3.33 115.58 114.98 3iuh h ASN 15 Ca 0.00 -0.74 -0.01 0.00 -0.55 0.00 0.00 56.30 55.00 3iuh h ASN 15 Cb 0.24 -0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.50 3iuh h ASN 15 CO 0.00 1.62 0.45 0.44 -1.65 0.00 0.00 177.43 178.28 3iuh h ASP 16 N -0.51 0.95 -0.06 5.81 3.32 -0.87 0.26 116.42 125.32 3iuh h ASP 16 Ca -0.35 -0.07 0.02 0.00 0.02 0.00 0.00 57.03 56.65 3iuh h ASP 16 Cb 1.62 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.93 3iuh h ASP 16 CO -0.05 0.75 0.07 -0.09 -1.72 0.00 0.00 179.24 178.20 3iuh h ARG 17 N 1.08 0.00 -0.00 3.56 2.43 -1.46 -2.79 114.38 117.20 3iuh h ARG 17 Ca 0.28 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.45 3iuh h ARG 17 Cb -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 3iuh h ARG 17 CO -0.05 0.00 -0.01 0.54 -1.51 0.00 0.00 179.97 178.94 3iuh n ARG 18 N -3.79 0.76 -0.34 0.20 1.74 -0.57 -4.76 116.66 109.91 3iuh n ARG 18 Ca -0.01 -0.47 0.02 0.00 -0.77 0.00 0.00 57.85 56.61 3iuh n ARG 18 Cb 0.16 -0.93 0.19 0.00 -1.02 0.00 0.00 32.46 30.86 3iuh n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3iuh h ALA 19 N 0.30 1.42 -0.22 7.54 0.00 -0.24 -1.79 119.26 126.27 3iuh h ALA 19 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3iuh h ALA 19 Cb 0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3iuh h ALA 19 CO 0.00 0.47 0.09 1.03 0.00 0.00 0.00 179.25 180.85 3iuh h SER 20 N 1.16 0.30 -0.64 0.00 0.87 -1.86 -0.81 113.55 112.57 3iuh h SER 20 Ca 0.39 -0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.73 3iuh h SER 20 Cb 0.08 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 3iuh h SER 20 CO -0.13 0.37 0.11 0.00 -0.53 0.00 0.00 176.83 176.65 3iuh h ALA 21 N 0.94 0.85 -0.77 6.23 0.00 -1.85 -2.57 119.26 122.09 3iuh h ALA 21 Ca 0.07 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 3iuh h ALA 21 Cb 0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3iuh h ALA 21 CO -0.01 0.61 0.33 1.25 0.00 0.00 0.00 179.25 181.42 3iuh h LEU 22 N 0.97 1.04 -0.87 0.00 5.85 -1.16 -0.91 115.31 120.23 3iuh h LEU 22 Ca 0.20 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 3iuh h LEU 22 Cb 0.43 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 3iuh h LEU 22 CO 0.01 0.91 0.41 0.50 -0.34 0.00 0.00 178.44 179.92 3iuh h LYS 23 N 1.11 1.22 -0.35 1.25 3.64 -0.95 0.21 116.57 122.71 3iuh h LYS 23 Ca 0.26 -0.18 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 3iuh h LYS 23 Cb 0.18 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 3iuh h LYS 23 CO -0.03 0.94 0.04 0.93 -2.27 0.00 0.00 179.45 179.06 3iuh h GLU 24 N 1.21 0.60 -0.24 1.90 4.39 -1.00 -2.15 114.58 119.29 3iuh h GLU 24 Ca 0.29 -0.17 -0.12 0.00 0.34 0.00 0.00 59.36 59.70 3iuh h GLU 24 Cb 0.12 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.70 3iuh h GLU 24 CO -0.04 0.69 -0.31 -0.44 -1.16 0.00 0.00 179.01 177.75 3iuh h ASP 25 N 0.43 0.69 -0.40 1.42 3.32 -0.86 -2.32 116.42 118.69 3iuh h ASP 25 Ca 0.10 -0.50 -0.01 0.00 0.02 0.00 0.00 57.03 56.64 3iuh h ASP 25 Cb 0.40 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 3iuh h ASP 25 CO 0.01 1.06 0.22 0.22 -1.72 0.00 0.00 179.24 179.02 3iuh h TYR 26 N 0.34 0.56 -0.50 4.55 3.20 -0.60 -1.31 116.97 123.22 3iuh h TYR 26 Ca 0.03 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.82 3iuh h TYR 26 Cb 0.89 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.96 3iuh h TYR 26 CO 0.08 0.44 0.06 0.93 -1.64 0.00 0.00 178.16 178.03 3iuh h GLU 27 N 0.52 0.84 -0.59 1.82 5.08 -1.42 0.26 114.58 121.09 3iuh h GLU 27 Ca 0.14 -0.24 0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3iuh h GLU 27 Cb 0.07 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 3iuh h GLU 27 CO -0.02 0.84 0.37 0.00 -1.00 0.00 0.00 179.01 179.20 3iuh h ALA 28 N 0.96 0.76 -0.23 3.43 0.00 -1.25 -0.67 119.26 122.26 3iuh h ALA 28 Ca 0.15 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 3iuh h ALA 28 Cb 0.42 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3iuh h ALA 28 CO 0.01 0.13 -0.37 1.25 0.00 0.00 0.00 179.25 180.27 3iuh h LEU 29 N 0.75 0.55 -0.91 0.00 5.85 -0.98 -1.38 115.31 119.19 3iuh h LEU 29 Ca 0.23 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 3iuh h LEU 29 Cb -0.02 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 40.81 3iuh h LEU 29 CO -0.08 0.87 0.46 1.23 -0.34 0.00 0.00 178.44 180.59 3iuh h GLY 30 N 1.07 1.33 1.00 3.75 0.00 0.25 0.11 103.07 110.57 3iuh h GLY 30 Ca 0.04 -0.62 -0.14 0.00 0.00 0.00 0.00 47.33 46.61 3iuh h GLY 30 CO 0.07 0.59 -0.39 0.00 0.00 0.00 0.00 176.54 176.81 3iuh h ALA 31 N 1.27 0.39 -0.60 3.60 0.00 -0.93 -0.71 119.26 122.28 3iuh h ALA 31 Ca 0.31 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 3iuh h ALA 31 Cb 0.05 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3iuh h ALA 31 CO -0.05 0.49 0.21 -0.97 0.00 0.00 0.00 179.25 178.93 3iuh h ASN 32 N 0.45 0.85 0.05 0.00 -0.73 -0.96 -1.42 115.58 113.82 3iuh h ASN 32 Ca 0.02 -0.19 -0.10 0.00 1.87 0.00 0.00 56.30 57.89 3iuh h ASN 32 Cb 0.98 -0.22 -0.01 0.00 0.27 0.00 0.00 38.32 39.34 3iuh h ASN 32 CO 0.09 0.82 -0.33 -0.07 -0.37 0.00 0.00 177.43 177.57 3iuh h LEU 33 N 0.84 0.41 -0.72 0.34 3.38 -0.75 -2.72 115.31 116.10 3iuh h LEU 33 Ca 0.19 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3iuh h LEU 33 Cb 0.26 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3iuh h LEU 33 CO -0.01 0.72 0.36 0.00 0.09 0.00 0.00 178.44 179.60 3iuh h ALA 34 N 1.31 0.92 0.00 1.53 0.00 -0.64 0.20 119.26 122.58 3iuh h ALA 34 Ca 0.04 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3iuh h ALA 34 Cb 0.75 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 3iuh h ALA 34 CO 0.06 0.48 -0.01 0.00 0.00 0.00 0.00 179.25 179.77 3iuh h ARG 35 N 1.00 0.00 -0.66 0.00 3.08 -0.98 -0.58 114.38 116.25 3iuh h ARG 35 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 3iuh h ARG 35 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 3iuh h ARG 35 CO -0.03 0.01 0.00 0.54 -1.07 0.00 0.00 179.97 179.42 3iuh n ARG 36 N -3.13 2.59 -2.34 0.04 1.74 -0.29 -4.94 116.66 110.32 3iuh n ARG 36 Ca -0.01 -2.47 -0.11 0.00 -0.77 0.00 0.00 57.85 54.49 3iuh n ARG 36 Cb 0.19 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.09 3iuh n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3iuh n GLY 37 N 1.59 -0.03 3.13 -0.13 0.00 -0.22 -5.03 105.19 104.51 3iuh n GLY 37 Ca 0.23 -0.40 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 3iuh n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iuh s VAL 38 N -2.63 1.59 -0.47 1.61 1.01 0.55 -5.00 120.40 117.05 3iuh s VAL 38 Ca 0.05 -0.76 -0.24 0.00 0.00 0.00 0.00 61.98 61.03 3iuh s VAL 38 Cb -0.02 -1.39 0.03 0.00 0.00 0.00 0.00 36.38 35.00 3iuh s VAL 38 CO 0.06 0.45 0.87 -0.62 0.00 0.00 0.00 175.10 175.86 3iuh s ASP 39 N 0.38 6.43 0.43 3.32 -1.08 -1.26 -3.09 116.67 121.80 3iuh s ASP 39 Ca -0.14 -0.08 0.13 0.00 -0.52 0.00 0.00 52.55 51.94 3iuh s ASP 39 Cb -0.16 -2.42 1.02 0.00 -1.46 0.00 0.00 42.92 39.90 3iuh s ASP 39 CO 0.05 -1.03 1.99 -0.29 0.52 0.00 0.00 175.17 176.42 3iuh h ILE 40 N 6.03 0.92 -0.93 4.11 2.10 -1.92 -1.32 117.51 126.50 3iuh h ILE 40 Ca -0.25 -0.14 -0.01 0.00 1.08 0.00 0.00 64.86 65.54 3iuh h ILE 40 Cb 1.08 0.47 -0.04 0.00 -1.09 0.00 0.00 36.82 37.24 3iuh h ILE 40 CO 1.01 0.08 0.55 -0.08 -1.08 0.00 0.00 178.15 178.63 3iuh h GLU 41 N 0.41 1.27 -0.51 2.19 4.57 -1.97 -1.32 114.58 119.23 3iuh h GLU 41 Ca 0.25 -0.12 -0.05 0.00 -1.18 0.00 0.00 59.36 58.26 3iuh h GLU 41 Cb 0.46 -0.26 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 3iuh h GLU 41 CO -0.07 0.90 0.11 0.00 -1.18 0.00 0.00 179.01 178.78 3iuh h ALA 42 N 1.30 1.24 -0.01 2.92 0.00 -1.66 -1.40 119.26 121.67 3iuh h ALA 42 Ca 0.33 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3iuh h ALA 42 Cb -0.03 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3iuh h ALA 42 CO -0.06 0.52 -0.01 0.28 0.00 0.00 0.00 179.25 179.99 3iuh h VAL 43 N 0.75 1.39 -0.82 0.00 2.07 -1.27 -2.81 116.25 115.56 3iuh h VAL 43 Ca 0.17 -1.16 0.09 0.00 0.82 0.00 0.00 66.70 66.62 3iuh h VAL 43 Cb 0.29 2.16 -0.07 0.00 -1.52 0.00 0.00 31.29 32.15 3iuh h VAL 43 CO -0.00 0.30 0.47 0.74 0.02 0.00 0.00 177.57 179.11 3iuh h THR 44 N -0.47 0.92 -0.83 2.57 2.02 -1.12 0.67 112.91 116.67 3iuh h THR 44 Ca 0.00 -0.27 0.03 0.00 0.77 0.00 0.00 66.41 66.94 3iuh h THR 44 Cb 0.50 0.05 -0.05 0.00 -1.74 0.00 0.00 68.15 66.91 3iuh h THR 44 CO 0.00 0.15 0.55 0.00 0.37 0.00 0.00 175.52 176.58 3iuh h ALA 45 N 1.45 1.47 -0.08 6.16 0.00 -1.24 -0.48 119.26 126.54 3iuh h ALA 45 Ca 0.39 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 55.02 3iuh h ALA 45 Cb 0.35 -0.30 0.02 0.00 0.00 0.00 0.00 17.79 17.86 3iuh h ALA 45 CO -0.24 0.45 -0.91 0.87 0.00 0.00 0.00 179.25 179.42 3iuh h LYS 46 N 1.05 0.76 -0.20 0.00 1.57 -0.87 -3.30 116.57 115.57 3iuh h LYS 46 Ca 0.32 -0.70 -0.01 0.00 -1.87 0.00 0.00 60.65 58.39 3iuh h LYS 46 Cb 0.00 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3iuh h LYS 46 CO -0.09 1.29 0.08 0.28 -0.57 0.00 0.00 179.45 180.45 3iuh h VAL 47 N 0.48 1.16 0.00 0.50 2.07 -0.38 -2.33 116.25 117.74 3iuh h VAL 47 Ca -0.09 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 66.95 3iuh h VAL 47 Cb 1.55 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 3iuh h VAL 47 CO 0.18 0.16 0.00 -1.84 0.02 0.00 0.00 177.57 176.09 3iuh n GLU 48 N -4.83 0.02 -0.09 1.57 0.28 -0.24 -0.84 120.64 116.51 3iuh n GLU 48 Ca -0.04 0.37 0.06 0.00 -0.16 0.00 0.00 57.16 57.40 3iuh n GLU 48 Cb 0.12 -1.50 0.11 0.00 1.43 0.00 0.00 31.44 31.60 3iuh n GLU 48 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3iuh n LYS 49 N -1.41 1.69 -3.07 3.44 5.02 -0.89 -4.94 118.16 117.99 3iuh n LYS 49 Ca 0.01 -1.64 -0.41 0.00 -2.02 0.00 0.00 58.31 54.25 3iuh n LYS 49 Cb 0.03 -1.27 -0.06 0.00 -0.02 0.00 0.00 35.03 33.71 3iuh n LYS 49 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 3iuh s PHE 50 N -1.03 3.23 0.16 2.13 5.36 -0.02 -5.05 117.98 122.77 3iuh s PHE 50 Ca 0.20 0.70 0.10 0.00 -0.96 0.00 0.00 56.93 56.98 3iuh s PHE 50 Cb 0.12 -3.00 -0.04 0.00 -0.34 0.00 0.00 43.02 39.76 3iuh s PHE 50 CO 0.17 -0.45 -0.21 -0.06 -1.46 0.00 0.00 175.22 173.20 3iuh s PHE 51 N 2.65 2.40 -0.02 10.12 0.08 -1.26 -4.74 117.98 127.21 3iuh s PHE 51 Ca 0.27 -0.32 -0.01 0.00 0.12 0.00 0.00 56.93 56.99 3iuh s PHE 51 Cb -0.15 -1.23 0.02 0.00 -0.57 0.00 0.00 43.02 41.10 3iuh s PHE 51 CO 0.11 0.45 0.05 0.54 -0.10 0.00 0.00 175.22 176.27 3iuh s VAL 52 N -1.45 -0.03 0.42 -0.44 0.11 -0.17 -4.82 120.40 114.01 3iuh s VAL 52 Ca 0.19 0.12 -0.24 0.00 -2.93 0.00 0.00 61.98 59.12 3iuh s VAL 52 Cb -0.09 -0.10 -0.08 0.00 -1.53 0.00 0.00 36.38 34.58 3iuh s VAL 52 CO 0.10 0.05 1.14 0.00 -3.33 0.00 0.00 175.10 173.06 3iuh s ALA 53 N 0.64 3.09 -0.12 1.54 0.00 -0.73 -4.18 121.76 121.99 3iuh s ALA 53 Ca -0.05 0.90 -0.03 0.00 0.00 0.00 0.00 51.96 52.78 3iuh s ALA 53 Cb -0.07 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 3iuh s ALA 53 CO -0.02 -0.50 0.00 0.14 0.00 0.00 0.00 175.76 175.38 3iuh s VAL 54 N -1.50 4.28 -0.09 0.00 -7.23 -0.45 -1.09 120.40 114.32 3iuh s VAL 54 Ca 0.59 -0.24 -0.30 0.00 -1.81 0.00 0.00 61.98 60.23 3iuh s VAL 54 Cb -0.28 -2.85 -0.02 0.00 0.56 0.00 0.00 36.38 33.79 3iuh s VAL 54 CO 0.35 0.55 1.11 -2.16 -0.31 0.00 0.00 175.10 174.64 3iuh s PRO 55 N -0.30 4.37 0.43 4.82 0.04 -1.24 -0.26 135.00 142.86 3iuh s PRO 55 Ca 0.06 1.53 0.15 0.00 0.04 0.00 0.00 61.00 62.78 3iuh s PRO 55 Cb -0.12 -3.56 1.04 0.00 0.04 0.00 0.00 34.50 31.89 3iuh s PRO 55 CO 0.02 -0.41 1.95 0.66 0.04 0.00 0.00 177.00 179.26 3iuh h SER 56 N 7.33 0.38 0.41 6.66 4.64 -1.71 -1.00 113.55 130.25 3iuh h SER 56 Ca -0.32 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 3iuh h SER 56 Cb 1.15 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3iuh h SER 56 CO 0.88 0.22 0.00 -2.67 -0.87 0.00 0.00 176.83 174.38 3iuh n TRP 57 N -4.47 0.00 1.12 4.77 2.14 -1.26 -3.25 117.44 116.49 3iuh n TRP 57 Ca 0.12 0.00 0.12 0.00 2.07 0.00 0.00 57.50 59.81 3iuh n TRP 57 Cb 0.45 -0.22 0.17 0.00 -0.81 0.00 0.00 31.31 30.90 3iuh n TRP 57 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 3iuh n GLY 58 N 1.02 0.12 0.02 -1.67 0.00 -0.38 -3.98 105.19 100.33 3iuh n GLY 58 Ca 0.15 -0.58 0.13 0.00 0.00 0.00 0.00 46.02 45.72 3iuh n GLY 58 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3iuh n VAL 59 N 0.20 0.13 -4.05 1.61 3.14 -1.20 -4.73 118.33 113.43 3iuh n VAL 59 Ca 0.12 -0.08 -0.22 0.00 -2.96 0.00 0.00 64.34 61.21 3iuh n VAL 59 Cb 0.46 -0.22 -0.04 0.00 -1.06 0.00 0.00 33.84 32.98 3iuh n VAL 59 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 3iuh s GLY 60 N -3.17 1.39 0.23 7.55 0.00 -1.26 -4.56 107.32 107.51 3iuh s GLY 60 Ca 0.12 -1.39 -0.30 0.00 0.00 0.00 0.00 44.72 43.15 3iuh s GLY 60 CO 0.62 -1.42 1.37 -1.59 0.00 0.00 0.00 173.10 172.08 3iuh s THR 61 N -2.11 2.91 0.56 0.90 2.01 -1.26 -4.66 115.64 113.99 3iuh s THR 61 Ca 0.34 0.77 0.03 0.00 0.31 0.00 0.00 61.69 63.13 3iuh s THR 61 Cb -0.08 -3.49 0.05 0.00 0.01 0.00 0.00 72.50 68.99 3iuh s THR 61 CO 0.26 0.13 0.78 -0.83 -0.69 0.00 0.00 174.62 174.27 3iuh s GLY 62 N 0.26 1.83 0.38 4.40 0.00 -0.55 -4.95 107.32 108.69 3iuh s GLY 62 Ca 0.57 -1.53 -0.09 0.00 0.00 0.00 0.00 44.72 43.67 3iuh s GLY 62 CO 0.42 -1.19 0.65 -0.32 0.00 0.00 0.00 173.10 172.66 3iuh s GLY 63 N -4.49 0.95 0.49 0.20 0.00 -1.26 -4.19 107.32 99.02 3iuh s GLY 63 Ca 0.59 -1.15 0.02 0.00 0.00 0.00 0.00 44.72 44.18 3iuh s GLY 63 CO 0.39 -0.65 0.16 -1.30 0.00 0.00 0.00 173.10 171.70 3iuh n THR 64 N -0.56 0.00 0.38 0.90 -2.24 -0.08 -4.98 114.28 107.69 3iuh n THR 64 Ca -0.04 -2.15 0.10 0.00 -2.27 0.00 0.00 64.05 59.69 3iuh n THR 64 Cb 0.61 0.23 0.42 0.00 -2.10 0.00 0.00 70.33 69.49 3iuh n THR 64 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3iuh n ARG 65 N -1.40 0.12 0.01 -0.78 1.85 -1.26 -2.58 116.66 112.63 3iuh n ARG 65 Ca -0.12 0.40 -0.16 0.00 -1.00 0.00 0.00 57.85 56.98 3iuh n ARG 65 Cb 0.59 -1.76 -0.14 0.00 -1.05 0.00 0.00 32.46 30.10 3iuh n ARG 65 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 3iuh h PHE 66 N 0.00 0.31 -1.13 2.89 0.04 -2.06 -3.49 116.94 113.50 3iuh h PHE 66 Ca 0.00 -0.23 0.35 0.00 2.80 0.00 0.00 57.97 60.89 3iuh h PHE 66 Cb 0.27 -0.01 -0.17 0.00 2.20 0.00 0.00 35.95 38.24 3iuh h PHE 66 CO 0.00 1.41 0.95 0.00 -0.60 0.00 0.00 178.31 180.07 3iuh s ALA 67 N -2.59 -2.32 -0.04 2.45 0.00 -1.06 -5.15 121.76 113.05 3iuh s ALA 67 Ca -0.13 1.34 0.02 0.00 0.00 0.00 0.00 51.96 53.19 3iuh s ALA 67 Cb 0.07 -0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.18 3iuh s ALA 67 CO 0.81 -0.83 -0.08 0.50 0.00 0.00 0.00 175.76 176.16 3iuh s ARG 68 N -2.12 1.11 -0.66 0.00 3.52 -1.26 -0.90 118.95 118.64 3iuh s ARG 68 Ca 0.13 -0.27 0.05 0.00 -0.13 0.00 0.00 55.73 55.51 3iuh s ARG 68 Cb 0.03 -1.01 0.16 0.00 -1.56 0.00 0.00 34.95 32.58 3iuh s ARG 68 CO -0.05 0.03 0.45 -0.06 -0.81 0.00 0.00 175.30 174.87 3iuh s PHE 69 N 0.53 3.34 0.61 5.12 0.40 -1.26 -5.07 117.98 121.65 3iuh s PHE 69 Ca -0.09 -3.24 -0.19 0.00 -0.60 0.00 0.00 56.93 52.81 3iuh s PHE 69 Cb -0.12 -2.60 -0.02 0.00 0.51 0.00 0.00 43.02 40.78 3iuh s PHE 69 CO 0.01 -0.59 1.29 -1.25 0.70 0.00 0.00 175.22 175.38 3iuh s PRO 70 N -1.17 2.78 0.00 0.24 0.04 -1.26 -4.95 135.00 130.67 3iuh s PRO 70 Ca 0.24 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.34 3iuh s PRO 70 Cb -0.07 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.51 3iuh s PRO 70 CO -0.14 -1.42 0.00 0.41 0.04 0.00 0.00 177.00 175.89 3iuh n GLY 71 N 0.78 1.21 3.91 0.56 0.00 -1.26 -5.09 105.19 105.30 3iuh n GLY 71 Ca 0.14 -1.94 -0.27 0.00 0.00 0.00 0.00 46.02 43.96 3iuh n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3iuh s THR 72 N 1.43 4.98 -1.41 2.61 -4.23 -1.26 -4.39 115.64 113.36 3iuh s THR 72 Ca 0.00 0.01 -0.10 0.00 -1.18 0.00 0.00 61.69 60.42 3iuh s THR 72 Cb 0.00 -3.83 0.04 0.00 1.34 0.00 0.00 72.50 70.05 3iuh s THR 72 CO 0.00 -0.64 1.09 0.61 -0.54 0.00 0.00 174.62 175.14 3iuh n GLY 73 N -1.81 -0.51 3.77 3.99 0.00 -1.26 -4.78 105.19 104.59 3iuh n GLY 73 Ca -0.01 0.22 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 3iuh n GLY 73 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iuh s GLU 74 N -6.37 4.13 0.26 1.61 0.41 -1.26 -4.72 118.70 112.76 3iuh s GLU 74 Ca 0.57 2.15 -0.30 0.00 -0.41 0.00 0.00 54.97 56.98 3iuh s GLU 74 Cb -0.26 -2.87 -0.10 0.00 -1.78 0.00 0.00 34.13 29.11 3iuh s GLU 74 CO 0.77 -0.36 1.45 -1.25 -0.49 0.00 0.00 175.26 175.38 3iuh s PRO 75 N -2.07 4.26 0.21 0.39 0.04 -1.26 -4.86 135.00 131.70 3iuh s PRO 75 Ca 0.54 2.33 0.16 0.00 0.04 0.00 0.00 61.00 64.06 3iuh s PRO 75 Cb -0.38 -3.10 -0.00 0.00 0.04 0.00 0.00 34.50 31.06 3iuh s PRO 75 CO 0.49 -0.43 1.24 0.00 0.04 0.00 0.00 177.00 178.34 3iuh h ARG 76 N 4.89 0.00 0.00 4.56 3.08 -1.93 -3.48 114.38 121.49 3iuh h ARG 76 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 3iuh h ARG 76 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 3iuh h ARG 76 CO 0.77 0.42 0.00 0.41 -1.07 0.00 0.00 179.97 180.50 3iuh n GLY 77 N 1.28 2.01 0.34 0.04 0.00 -1.26 -5.03 105.19 102.57 3iuh n GLY 77 Ca -0.02 -0.82 -0.01 0.00 0.00 0.00 0.00 46.02 45.17 3iuh n GLY 77 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3iuh h ILE 78 N 0.45 1.22 -0.53 -0.61 6.09 -1.91 -1.59 117.51 120.62 3iuh h ILE 78 Ca 0.00 -0.51 -0.11 0.00 -1.37 0.00 0.00 64.86 62.87 3iuh h ILE 78 Cb 0.00 0.18 -0.02 0.00 0.47 0.00 0.00 36.82 37.45 3iuh h ILE 78 CO 0.00 0.24 -0.10 -0.26 -3.07 0.00 0.00 178.15 174.96 3iuh h PHE 79 N 1.04 1.10 -0.51 2.19 0.04 -1.97 0.10 116.94 118.94 3iuh h PHE 79 Ca 0.27 -0.22 -0.07 0.00 2.80 0.00 0.00 57.97 60.75 3iuh h PHE 79 Cb -0.01 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.85 3iuh h PHE 79 CO 0.01 1.02 0.04 -0.44 -0.60 0.00 0.00 178.31 178.34 3iuh h ASP 80 N 0.89 0.85 -1.01 2.17 3.32 -1.91 -1.55 116.42 119.18 3iuh h ASP 80 Ca 0.14 -0.29 0.02 0.00 0.02 0.00 0.00 57.03 56.93 3iuh h ASP 80 Cb 0.65 -0.23 -0.05 0.00 0.22 0.00 0.00 39.33 39.92 3iuh h ASP 80 CO 0.05 0.93 0.66 0.11 -1.72 0.00 0.00 179.24 179.27 3iuh h LYS 81 N 0.75 1.28 -0.40 3.56 1.57 -0.83 -1.01 116.57 121.49 3iuh h LYS 81 Ca 0.15 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.78 3iuh h LYS 81 Cb 0.46 -0.29 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3iuh h LYS 81 CO 0.02 0.84 -0.05 -0.07 -0.57 0.00 0.00 179.45 179.63 3iuh h LEU 82 N 1.32 0.73 -0.55 2.94 3.38 -0.55 -0.06 115.31 122.51 3iuh h LEU 82 Ca 0.39 -0.34 0.08 0.00 0.09 0.00 0.00 57.88 58.10 3iuh h LEU 82 Cb -0.07 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.41 3iuh h LEU 82 CO -0.10 0.90 0.19 0.44 0.09 0.00 0.00 178.44 179.96 3iuh h ASP 83 N 0.56 0.18 -0.31 -0.43 3.32 -0.48 0.04 116.42 119.31 3iuh h ASP 83 Ca 0.11 0.07 -0.15 0.00 0.02 0.00 0.00 57.03 57.08 3iuh h ASP 83 Cb 0.55 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 3iuh h ASP 83 CO 0.03 0.12 -0.38 0.44 -1.72 0.00 0.00 179.24 177.73 3iuh h ASP 84 N 0.37 0.91 -0.09 6.45 3.32 -1.04 -2.69 116.42 123.65 3iuh h ASP 84 Ca 0.27 -0.41 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 3iuh h ASP 84 Cb 0.32 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 3iuh h ASP 84 CO -0.28 1.18 0.04 0.00 -1.72 0.00 0.00 179.24 178.46 3iuh h ALA 86 N 1.88 1.56 -0.34 0.00 0.00 -0.66 -2.12 119.26 119.57 3iuh h ALA 86 Ca 0.04 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.67 3iuh h ALA 86 Cb 0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3iuh h ALA 86 CO -0.00 0.21 -0.30 0.28 0.00 0.00 0.00 179.25 179.43 3iuh h VAL 87 N 0.00 1.29 -0.16 0.00 2.07 -1.11 -0.72 116.25 117.62 3iuh h VAL 87 Ca -0.00 -1.47 -0.00 0.00 0.82 0.00 0.00 66.70 66.05 3iuh h VAL 87 Cb 0.33 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 3iuh h VAL 87 CO 0.02 0.48 0.10 0.40 0.02 0.00 0.00 177.57 178.59 3iuh h ILE 88 N 0.58 1.07 -0.23 4.57 2.04 -1.32 -1.79 117.51 122.43 3iuh h ILE 88 Ca 0.06 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3iuh h ILE 88 Cb 0.88 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 3iuh h ILE 88 CO 0.08 0.06 0.06 -0.61 0.00 0.00 0.00 178.15 177.74 3iuh h GLN 89 N 0.20 0.36 -0.60 2.37 5.75 -1.39 -0.62 115.11 121.17 3iuh h GLN 89 Ca 0.06 -0.09 0.04 0.00 -0.15 0.00 0.00 58.65 58.51 3iuh h GLN 89 Cb 0.01 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.47 3iuh h GLN 89 CO -0.01 0.47 0.35 0.37 -2.65 0.00 0.00 178.83 177.35 3iuh h GLN 90 N 0.19 0.65 0.22 1.69 4.15 -1.00 0.68 115.11 121.69 3iuh h GLN 90 Ca 0.07 -0.04 -0.33 0.00 0.77 0.00 0.00 58.65 59.12 3iuh h GLN 90 Cb 0.27 -0.15 0.03 0.00 0.21 0.00 0.00 27.48 27.84 3iuh h GLN 90 CO 0.00 0.43 -1.49 -0.07 -1.93 0.00 0.00 178.83 175.76 3iuh h LEU 91 N 0.67 0.74 0.00 -2.39 3.38 -1.30 -3.35 115.31 113.06 3iuh h LEU 91 Ca 0.25 -0.84 -0.18 0.00 0.09 0.00 0.00 57.88 57.21 3iuh h LEU 91 Cb 0.09 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 3iuh h LEU 91 CO -0.13 1.66 -1.99 0.35 0.09 0.00 0.00 178.44 178.42 3iuh n THR 92 N -3.66 0.82 -1.68 0.22 -2.24 -0.25 -1.06 114.28 106.42 3iuh n THR 92 Ca -0.17 -0.68 -0.17 0.00 -2.27 0.00 0.00 64.05 60.75 3iuh n THR 92 Cb 1.09 -0.35 -0.06 0.00 -2.10 0.00 0.00 70.33 68.91 3iuh n THR 92 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3iuh n ARG 93 N -2.60 -1.48 0.00 -0.78 5.12 0.24 -4.79 116.66 112.36 3iuh n ARG 93 Ca -0.16 1.00 0.03 0.00 -1.93 0.00 0.00 57.85 56.79 3iuh n ARG 93 Cb 0.86 -5.38 0.03 0.00 -1.16 0.00 0.00 32.46 26.80 3iuh n ARG 93 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3iuh n ALA 94 N 0.39 2.50 -3.03 7.54 0.00 -1.26 -4.76 120.51 121.90 3iuh n ALA 94 Ca -0.18 -0.54 -0.20 0.00 0.00 0.00 0.00 53.44 52.52 3iuh n ALA 94 Cb 0.59 -0.23 -0.03 0.00 0.00 0.00 0.00 19.45 19.78 3iuh n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3iuh n THR 95 N 0.32 1.09 0.35 0.00 -2.24 -1.26 -1.00 114.28 111.54 3iuh n THR 95 Ca 0.04 -4.78 0.10 0.00 -2.27 0.00 0.00 64.05 57.14 3iuh n THR 95 Cb 0.17 -0.58 0.43 0.00 -2.10 0.00 0.00 70.33 68.25 3iuh n THR 95 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 3iuh n PRO 96 N 0.04 0.13 -5.27 -0.78 -0.04 -1.26 -4.46 135.00 123.37 3iuh n PRO 96 Ca 0.26 0.43 -0.31 0.00 -0.04 0.00 0.00 63.50 63.84 3iuh n PRO 96 Cb 0.59 -1.78 -0.16 0.00 -0.04 0.00 0.00 33.50 32.11 3iuh n PRO 96 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3iuh s ASN 97 N -3.85 3.04 -0.06 3.54 0.02 -1.26 -0.03 114.94 116.34 3iuh s ASN 97 Ca 0.03 -0.50 0.00 0.00 -1.02 0.00 0.00 52.86 51.38 3iuh s ASN 97 Cb 0.08 -0.70 -0.03 0.00 0.02 0.00 0.00 41.25 40.62 3iuh s ASN 97 CO 0.30 0.26 -0.04 -0.69 0.02 0.00 0.00 177.10 176.96 3iuh s VAL 98 N -0.28 3.96 -0.27 1.60 1.01 0.14 -1.34 120.40 125.22 3iuh s VAL 98 Ca 0.00 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 3iuh s VAL 98 Cb -0.13 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.55 3iuh s VAL 98 CO 0.02 0.57 0.17 -0.55 0.00 0.00 0.00 175.10 175.31 3iuh s SER 99 N -0.94 5.92 0.37 3.32 0.15 0.64 -0.21 113.70 122.94 3iuh s SER 99 Ca 0.14 -0.02 -0.10 0.00 0.70 0.00 0.00 55.95 56.68 3iuh s SER 99 Cb -0.11 -2.09 -0.06 0.00 -1.71 0.00 0.00 66.02 62.04 3iuh s SER 99 CO 0.03 -0.03 0.72 -0.76 1.20 0.00 0.00 173.24 174.40 3iuh s LEU 100 N 1.62 3.90 -0.11 3.45 1.02 -1.24 -1.74 118.68 125.58 3iuh s LEU 100 Ca 0.07 1.05 0.01 0.00 0.02 0.00 0.00 54.13 55.28 3iuh s LEU 100 Cb -0.15 -3.91 0.02 0.00 0.02 0.00 0.00 46.19 42.16 3iuh s LEU 100 CO 0.09 -0.33 -0.14 -2.28 0.02 0.00 0.00 176.35 173.71 3iuh s HIS 101 N -2.27 1.88 -0.04 0.29 2.46 -1.26 -1.30 115.29 115.05 3iuh s HIS 101 Ca 0.50 -0.90 0.01 0.00 0.47 0.00 0.00 55.06 55.14 3iuh s HIS 101 Cb -0.10 -1.38 -0.03 0.00 -0.13 0.00 0.00 32.58 30.93 3iuh s HIS 101 CO 0.30 -0.49 -0.03 0.42 -2.47 0.00 0.00 174.74 172.46 3iuh s ILE 102 N 1.12 3.94 -2.09 0.89 1.09 -0.57 0.05 121.20 125.63 3iuh s ILE 102 Ca -0.04 -0.52 0.30 0.00 -1.10 0.00 0.00 60.65 59.29 3iuh s ILE 102 Cb -0.14 -2.68 0.74 0.00 -1.06 0.00 0.00 42.46 39.32 3iuh s ILE 102 CO -0.03 0.50 2.04 -0.81 -0.10 0.00 0.00 174.94 176.54 3iuh n PRO 103 N 1.85 1.14 -0.29 2.79 -0.04 -1.26 -2.69 135.00 136.50 3iuh n PRO 103 Ca -0.17 -0.30 0.10 0.00 -0.04 0.00 0.00 63.50 63.09 3iuh n PRO 103 Cb 0.53 -1.49 0.26 0.00 -0.04 0.00 0.00 33.50 32.75 3iuh n PRO 103 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3iuh h TRP 104 N 0.74 0.52 -0.57 0.54 6.55 -1.91 -0.96 115.95 120.86 3iuh h TRP 104 Ca 0.00 0.04 -0.01 0.00 0.95 0.00 0.00 58.89 59.87 3iuh h TRP 104 Cb 0.19 -0.10 -0.01 0.00 -0.86 0.00 0.00 29.16 28.39 3iuh h TRP 104 CO 0.00 -0.05 0.01 -0.25 -1.05 0.00 0.00 178.44 177.10 3iuh n ASP 105 N -5.08 5.66 -4.69 -3.49 8.00 0.11 -4.73 116.55 112.33 3iuh n ASP 105 Ca 0.19 -2.96 -0.44 0.00 0.71 0.00 0.00 54.79 52.29 3iuh n ASP 105 Cb 0.57 -0.69 -0.03 0.00 -0.02 0.00 0.00 41.12 40.95 3iuh n ASP 105 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3iuh n LYS 106 N 0.54 2.36 -3.60 -1.24 0.00 -0.37 -4.92 118.16 110.93 3iuh n LYS 106 Ca 0.28 0.85 -0.03 0.00 0.00 0.00 0.00 58.31 59.41 3iuh n LYS 106 Cb 1.20 -2.62 -0.02 0.00 0.00 0.00 0.00 35.03 33.60 3iuh n LYS 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3iuh s ALA 107 N 0.74 -2.05 -0.46 3.14 0.00 -1.26 -5.00 121.76 116.87 3iuh s ALA 107 Ca 0.75 1.19 -0.33 0.00 0.00 0.00 0.00 51.96 53.57 3iuh s ALA 107 Cb -0.61 0.13 -0.12 0.00 0.00 0.00 0.00 23.12 22.52 3iuh s ALA 107 CO 0.39 -0.75 2.29 -3.47 0.00 0.00 0.00 175.76 174.22 3iuh n ASP 108 N -0.24 1.89 -0.32 0.00 2.03 -1.26 -4.78 116.55 113.87 3iuh n ASP 108 Ca -0.03 0.25 0.17 0.00 0.52 0.00 0.00 54.79 55.69 3iuh n ASP 108 Cb 0.60 -1.26 0.37 0.00 -0.72 0.00 0.00 41.12 40.11 3iuh n ASP 108 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3iuh h PRO 109 N 13.37 0.32 -0.69 -0.67 0.11 -1.96 0.52 132.00 143.00 3iuh h PRO 109 Ca -0.23 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.82 3iuh h PRO 109 Cb 1.31 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 3iuh h PRO 109 CO 1.09 0.21 0.29 -0.22 -0.21 0.00 0.00 178.00 179.16 3iuh h LYS 110 N 0.33 1.02 -0.24 1.05 1.63 -1.88 -1.26 116.57 117.22 3iuh h LYS 110 Ca 0.63 -0.16 -0.03 0.00 -0.85 0.00 0.00 60.65 60.23 3iuh h LYS 110 Cb 1.31 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.75 3iuh h LYS 110 CO -0.59 0.82 0.02 0.93 -3.45 0.00 0.00 179.45 177.17 3iuh h GLU 111 N 1.00 0.40 -0.33 1.90 5.08 -0.39 -1.78 114.58 120.46 3iuh h GLU 111 Ca 0.24 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.52 3iuh h GLU 111 Cb 0.17 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 3iuh h GLU 111 CO -0.02 0.57 0.07 -0.07 -1.00 0.00 0.00 179.01 178.55 3iuh h LEU 112 N 0.19 0.02 -1.15 1.33 3.38 -0.75 -1.57 115.31 116.76 3iuh h LEU 112 Ca 0.07 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3iuh h LEU 112 Cb 0.37 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 3iuh h LEU 112 CO 0.01 0.05 0.53 0.50 0.09 0.00 0.00 178.44 179.62 3iuh h LYS 113 N 0.18 1.10 0.41 1.13 1.63 -1.17 -0.51 116.57 119.35 3iuh h LYS 113 Ca 0.15 -0.08 -0.02 0.00 -0.85 0.00 0.00 60.65 59.86 3iuh h LYS 113 Cb 0.17 -0.24 0.00 0.00 -0.60 0.00 0.00 32.23 31.56 3iuh h LYS 113 CO -0.20 0.75 -0.20 0.00 -3.45 0.00 0.00 179.45 176.35 3iuh h ALA 114 N 1.45 -0.55 -0.71 5.00 0.00 -0.40 -0.97 119.26 123.08 3iuh h ALA 114 Ca 0.30 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 3iuh h ALA 114 Cb -0.10 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3iuh h ALA 114 CO -0.06 -0.80 0.27 0.00 0.00 0.00 0.00 179.25 178.66 3iuh h ARG 115 N -0.56 1.06 0.26 0.00 2.47 -1.14 -1.17 114.38 115.30 3iuh h ARG 115 Ca -0.06 -0.19 0.01 0.00 -1.26 0.00 0.00 59.98 58.48 3iuh h ARG 115 Cb 0.43 -0.17 -0.03 0.00 -1.65 0.00 0.00 29.97 28.54 3iuh h ARG 115 CO 0.09 0.87 -0.38 0.78 0.56 0.00 0.00 179.97 181.89 3iuh h GLY 116 N 1.09 -0.84 0.74 0.04 0.00 -0.86 0.32 103.07 103.56 3iuh h GLY 116 Ca 0.24 0.45 0.06 0.00 0.00 0.00 0.00 47.33 48.08 3iuh h GLY 116 CO -0.02 -0.29 0.53 -0.55 0.00 0.00 0.00 176.54 176.21 3iuh h ASP 117 N -0.71 0.83 -0.35 0.19 3.32 -1.01 0.20 116.42 118.89 3iuh h ASP 117 Ca -0.01 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3iuh h ASP 117 Cb 0.68 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 3iuh h ASP 117 CO -0.14 0.54 0.22 0.00 -1.72 0.00 0.00 179.24 178.14 3iuh h ALA 118 N 1.40 0.45 0.00 3.45 0.00 -0.50 -2.57 119.26 121.48 3iuh h ALA 118 Ca 0.37 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3iuh h ALA 118 Cb 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3iuh h ALA 118 CO -0.17 -0.07 0.00 1.28 0.00 0.00 0.00 179.25 180.29 3iuh n LEU 119 N -4.82 0.00 -0.23 0.00 4.77 0.11 -4.91 117.00 111.91 3iuh n LEU 119 Ca -0.00 0.41 -0.01 0.00 -0.03 0.00 0.00 56.01 56.38 3iuh n LEU 119 Cb 0.04 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 3iuh n LEU 119 CO 0.35 -0.02 -0.00 0.61 -1.33 0.00 0.00 177.39 177.00 3iuh n GLY 120 N 1.30 0.51 3.44 -0.72 0.00 0.03 -4.91 105.19 104.83 3iuh n GLY 120 Ca 0.10 -0.80 -0.25 0.00 0.00 0.00 0.00 46.02 45.06 3iuh n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iuh s LEU 121 N -0.50 2.50 0.42 0.99 1.43 0.51 -4.90 118.68 119.13 3iuh s LEU 121 Ca 0.01 -0.93 0.04 0.00 -1.03 0.00 0.00 54.13 52.21 3iuh s LEU 121 Cb -0.00 -1.12 -0.04 0.00 0.03 0.00 0.00 46.19 45.05 3iuh s LEU 121 CO 0.01 0.08 0.05 -0.83 0.23 0.00 0.00 176.35 175.89 3iuh s GLY 122 N -3.01 2.60 -0.12 -3.19 0.00 0.96 -3.88 107.32 100.67 3iuh s GLY 122 Ca 0.24 -1.36 0.01 0.00 0.00 0.00 0.00 44.72 43.61 3iuh s GLY 122 CO 0.12 -1.99 -0.15 -1.36 0.00 0.00 0.00 173.10 169.71 3iuh s PHE 123 N -3.03 2.75 0.00 1.90 0.40 -1.26 0.26 117.98 119.00 3iuh s PHE 123 Ca 0.23 -0.71 0.00 0.00 -0.60 0.00 0.00 56.93 55.85 3iuh s PHE 123 Cb 0.05 -1.81 0.00 0.00 0.51 0.00 0.00 43.02 41.77 3iuh s PHE 123 CO 0.12 -0.24 0.00 -3.47 0.70 0.00 0.00 175.22 172.33 3iuh n ASP 124 N 3.48 0.00 -4.57 1.36 2.03 0.71 -4.23 116.55 115.32 3iuh n ASP 124 Ca -0.18 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 54.73 3iuh n ASP 124 Cb 0.53 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.95 3iuh n ASP 124 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3iuh n ALA 125 N -3.00 -0.22 -2.14 -1.67 0.00 -1.26 -4.55 120.51 107.67 3iuh n ALA 125 Ca 0.00 0.14 -0.32 0.00 0.00 0.00 0.00 53.44 53.27 3iuh n ALA 125 Cb 0.00 -2.01 -0.05 0.00 0.00 0.00 0.00 19.45 17.39 3iuh n ALA 125 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3iuh s MET 126 N -2.11 3.91 -0.18 0.00 -1.94 0.42 -3.65 119.30 115.75 3iuh s MET 126 Ca 0.66 0.61 0.00 0.00 -1.71 0.00 0.00 55.69 55.25 3iuh s MET 126 Cb -0.52 -2.40 0.04 0.00 2.01 0.00 0.00 34.83 33.96 3iuh s MET 126 CO 0.55 0.06 -0.10 -0.80 -0.01 0.00 0.00 175.02 174.72 3iuh s ASN 127 N -2.65 3.10 0.70 3.03 0.01 -0.42 0.08 114.94 118.79 3iuh s ASN 127 Ca 0.53 -0.74 -0.11 0.00 -0.71 0.00 0.00 52.86 51.83 3iuh s ASN 127 Cb -0.10 -1.14 0.01 0.00 0.41 0.00 0.00 41.25 40.43 3iuh s ASN 127 CO 0.23 -0.13 1.09 -0.94 -1.51 0.00 0.00 177.10 175.83 3iuh s SER 128 N 1.47 5.43 -0.31 -1.22 1.04 -1.10 -1.51 113.70 117.51 3iuh s SER 128 Ca 0.01 1.22 -0.03 0.00 0.48 0.00 0.00 55.95 57.63 3iuh s SER 128 Cb -0.15 -2.05 0.11 0.00 0.10 0.00 0.00 66.02 64.03 3iuh s SER 128 CO -0.09 -1.36 0.16 0.21 0.98 0.00 0.00 173.24 173.14 3iuh s ASN 129 N -4.25 3.34 -0.17 7.02 3.84 -1.10 -4.70 114.94 118.92 3iuh s ASN 129 Ca 0.58 -1.60 0.13 0.00 0.21 0.00 0.00 52.86 52.18 3iuh s ASN 129 Cb -0.12 -0.37 0.41 0.00 -0.55 0.00 0.00 41.25 40.62 3iuh s ASN 129 CO 0.53 -0.39 1.21 0.35 -2.79 0.00 0.00 177.10 176.00 3iuh n THR 130 N 4.83 1.88 0.06 -5.21 -2.24 -1.26 -4.58 114.28 107.76 3iuh n THR 130 Ca 0.00 -2.85 0.06 0.00 -2.27 0.00 0.00 64.05 58.99 3iuh n THR 130 Cb 0.40 -0.07 0.13 0.00 -2.10 0.00 0.00 70.33 68.69 3iuh n THR 130 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 3iuh n PHE 131 N -0.92 0.33 -3.65 4.78 1.16 -1.26 -4.58 117.46 113.32 3iuh n PHE 131 Ca 0.17 -0.32 -0.14 0.00 -1.87 0.00 0.00 57.45 55.29 3iuh n PHE 131 Cb 0.75 -0.02 -0.07 0.00 -1.61 0.00 0.00 39.48 38.53 3iuh n PHE 131 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 3iuh s SER 132 N -1.01 -0.36 0.13 5.98 1.04 -1.26 -4.94 113.70 113.28 3iuh s SER 132 Ca 0.22 0.20 -0.15 0.00 0.48 0.00 0.00 55.95 56.70 3iuh s SER 132 Cb 0.12 0.42 -0.07 0.00 0.10 0.00 0.00 66.02 66.60 3iuh s SER 132 CO 0.17 -0.60 0.54 -1.81 0.98 0.00 0.00 173.24 172.52 3iuh s ASP 133 N -1.63 6.84 0.33 7.02 1.01 -1.26 -4.89 116.67 124.09 3iuh s ASP 133 Ca -0.09 1.08 0.08 0.00 0.71 0.00 0.00 52.55 54.33 3iuh s ASP 133 Cb -0.02 -2.29 -0.03 0.00 1.01 0.00 0.00 42.92 41.59 3iuh s ASP 133 CO 0.02 0.14 0.23 0.00 0.21 0.00 0.00 175.17 175.77 3iuh s ALA 134 N -1.41 3.70 0.30 5.23 0.00 -1.26 -5.06 121.76 123.26 3iuh s ALA 134 Ca 0.36 -1.71 -0.30 0.00 0.00 0.00 0.00 51.96 50.32 3iuh s ALA 134 Cb -0.16 -1.01 -0.11 0.00 0.00 0.00 0.00 23.12 21.84 3iuh s ALA 134 CO 0.19 0.03 1.60 -2.30 0.00 0.00 0.00 175.76 175.28 3iuh n PRO 135 N -1.28 2.74 -0.96 0.00 -0.02 -1.26 -2.13 135.00 132.10 3iuh n PRO 135 Ca -0.03 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 3iuh n PRO 135 Cb 0.60 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 3iuh n PRO 135 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iuh n GLY 136 N 2.04 0.41 3.70 -1.23 0.00 -1.26 -4.97 105.19 103.87 3iuh n GLY 136 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 3iuh n GLY 136 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3iuh s GLN 137 N -0.59 4.26 0.07 1.61 0.74 -0.91 -4.95 119.66 119.89 3iuh s GLN 137 Ca 0.00 2.16 -0.27 0.00 0.05 0.00 0.00 55.36 57.30 3iuh s GLN 137 Cb 0.00 -3.42 -0.17 0.00 1.10 0.00 0.00 33.01 30.53 3iuh s GLN 137 CO 0.00 -0.58 1.61 0.00 -0.55 0.00 0.00 175.29 175.77 3iuh h ALA 138 N 7.50 -0.34 -4.41 1.58 0.00 -1.93 -3.44 119.26 118.21 3iuh h ALA 138 Ca -0.41 -0.10 -0.70 0.00 0.00 0.00 0.00 54.91 53.70 3iuh h ALA 138 Cb 1.20 0.13 -0.28 0.00 0.00 0.00 0.00 17.79 18.84 3iuh h ALA 138 CO 0.90 -0.65 -0.85 -1.01 0.00 0.00 0.00 179.25 177.63 3iuh s HIS 139 N -5.83 2.44 0.39 0.00 3.76 -1.26 -5.12 115.29 109.68 3iuh s HIS 139 Ca -0.15 -0.37 -0.24 0.00 -0.15 0.00 0.00 55.06 54.15 3iuh s HIS 139 Cb 0.04 -1.54 -0.10 0.00 1.11 0.00 0.00 32.58 32.10 3iuh s HIS 139 CO 0.63 0.02 1.00 0.45 -0.85 0.00 0.00 174.74 175.99 3iuh s SER 140 N -0.62 6.93 -0.21 1.40 0.15 -1.26 -4.95 113.70 115.13 3iuh s SER 140 Ca 0.10 1.91 0.12 0.00 0.70 0.00 0.00 55.95 58.78 3iuh s SER 140 Cb -0.10 -2.57 0.73 0.00 -1.71 0.00 0.00 66.02 62.36 3iuh s SER 140 CO -0.00 -0.36 1.61 -1.22 1.20 0.00 0.00 173.24 174.46 3iuh n TYR 141 N -0.05 1.86 -0.32 3.44 4.01 -1.26 -4.52 117.16 120.31 3iuh n TYR 141 Ca 0.05 -0.64 0.04 0.00 -0.16 0.00 0.00 57.90 57.19 3iuh n TYR 141 Cb 0.51 -0.47 0.23 0.00 -0.31 0.00 0.00 39.34 39.30 3iuh n TYR 141 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3iuh h LYS 142 N 3.56 1.01 -0.45 -0.72 3.64 -1.94 -2.13 116.57 119.55 3iuh h LYS 142 Ca 0.00 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 3iuh h LYS 142 Cb 1.82 -0.23 -0.06 0.00 -0.41 0.00 0.00 32.23 33.35 3iuh h LYS 142 CO 0.44 0.67 0.07 0.66 -2.27 0.00 0.00 179.45 179.02 3iuh n TYR 143 N -4.51 1.52 0.00 1.91 4.01 -1.26 -5.06 117.16 113.77 3iuh n TYR 143 Ca 0.15 -1.09 0.00 0.00 -0.16 0.00 0.00 57.90 56.80 3iuh n TYR 143 Cb 0.22 -0.47 0.00 0.00 -0.31 0.00 0.00 39.34 38.78 3iuh n TYR 143 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3iuh n GLY 144 N -0.43 0.99 0.00 2.72 0.00 -0.80 -4.65 105.19 103.03 3iuh n GLY 144 Ca 0.30 -2.31 0.00 0.00 0.00 0.00 0.00 46.02 44.01 3iuh n GLY 144 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3iuh n SER 145 N 0.00 0.00 0.31 1.61 3.41 -1.26 -4.25 113.62 113.43 3iuh n SER 145 Ca 0.00 0.00 0.19 0.00 -0.26 0.00 0.00 58.87 58.80 3iuh n SER 145 Cb 0.00 0.00 0.97 0.00 -0.26 0.00 0.00 64.21 64.92 3iuh n SER 145 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3iuh h LEU 146 N 0.00 0.00 -3.02 1.04 3.38 -1.87 -2.30 115.31 112.54 3iuh h LEU 146 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3iuh h LEU 146 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3iuh h LEU 146 CO 0.00 0.02 0.00 -1.54 0.09 0.00 0.00 178.44 177.01 3iuh n SER 147 N -3.19 2.65 -4.74 -0.43 3.41 -1.26 -3.88 113.62 106.17 3iuh n SER 147 Ca -0.02 -2.42 -0.38 0.00 -0.26 0.00 0.00 58.87 55.79 3iuh n SER 147 Cb 0.17 -0.25 0.05 0.00 -0.26 0.00 0.00 64.21 63.92 3iuh n SER 147 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3iuh n HIS 148 N -0.45 2.19 0.25 7.33 -0.00 -0.87 -4.80 115.22 118.88 3iuh n HIS 148 Ca 0.10 0.43 0.11 0.00 -0.00 0.00 0.00 57.72 58.36 3iuh n HIS 148 Cb 0.50 -2.34 0.64 0.00 -0.00 0.00 0.00 29.99 28.79 3iuh n HIS 148 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.34 178.13 3iuh h THR 149 N 1.19 0.69 -3.37 3.57 1.35 -1.91 -3.42 112.91 111.02 3iuh h THR 149 Ca -0.51 -0.68 -0.60 0.00 -0.55 0.00 0.00 66.41 64.07 3iuh h THR 149 Cb 1.31 1.42 -0.10 0.00 -1.73 0.00 0.00 68.15 69.06 3iuh h THR 149 CO 0.56 0.16 0.40 0.21 -0.25 0.00 0.00 175.52 176.60 3iuh s ASN 150 N -6.31 6.73 0.19 5.36 2.47 -1.26 -4.95 114.94 117.16 3iuh s ASN 150 Ca -0.03 0.85 -0.12 0.00 0.42 0.00 0.00 52.86 53.99 3iuh s ASN 150 Cb 0.13 -2.41 0.22 0.00 -1.45 0.00 0.00 41.25 37.74 3iuh s ASN 150 CO 0.61 -0.53 1.72 0.00 -3.72 0.00 0.00 177.10 175.19 3iuh h ALA 151 N 7.87 0.62 -0.99 1.71 0.00 -1.99 -1.67 119.26 124.82 3iuh h ALA 151 Ca -0.24 0.10 0.08 0.00 0.00 0.00 0.00 54.91 54.85 3iuh h ALA 151 Cb 1.10 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.94 3iuh h ALA 151 CO 0.86 -0.28 0.64 0.00 0.00 0.00 0.00 179.25 180.47 3iuh h ALA 152 N 1.40 1.46 -0.39 0.00 0.00 -1.96 -0.38 119.26 119.39 3iuh h ALA 152 Ca 0.27 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.12 3iuh h ALA 152 Cb 0.35 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3iuh h ALA 152 CO -0.32 0.36 0.06 1.15 0.00 0.00 0.00 179.25 180.50 3iuh h THR 153 N 1.10 1.24 -0.42 0.00 2.02 -1.68 -1.60 112.91 113.57 3iuh h THR 153 Ca 0.45 -0.87 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 3iuh h THR 153 Cb 0.27 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 3iuh h THR 153 CO -0.19 0.30 0.26 0.03 0.37 0.00 0.00 175.52 176.28 3iuh h ARG 154 N 0.50 0.57 -0.95 6.66 3.08 -0.79 -0.72 114.38 122.74 3iuh h ARG 154 Ca 0.12 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 3iuh h ARG 154 Cb 0.37 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.26 3iuh h ARG 154 CO 0.01 0.42 0.59 0.00 -1.07 0.00 0.00 179.97 179.92 3iuh h ALA 155 N 1.12 1.25 -0.78 0.04 0.00 -0.98 0.16 119.26 120.06 3iuh h ALA 155 Ca 0.15 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 3iuh h ALA 155 Cb -0.01 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.36 3iuh h ALA 155 CO -0.03 0.66 0.28 0.37 0.00 0.00 0.00 179.25 180.53 3iuh h GLN 156 N 1.31 1.19 -0.48 0.00 4.15 -0.82 0.52 115.11 120.97 3iuh h GLN 156 Ca 0.34 -0.23 -0.07 0.00 0.77 0.00 0.00 58.65 59.47 3iuh h GLN 156 Cb -0.09 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.40 3iuh h GLN 156 CO -0.07 0.98 0.05 0.00 -1.93 0.00 0.00 178.83 177.86 3iuh h ALA 157 N 1.15 0.64 -0.21 3.38 0.00 -0.10 -1.66 119.26 122.47 3iuh h ALA 157 Ca 0.26 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3iuh h ALA 157 Cb 0.26 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3iuh h ALA 157 CO -0.02 0.40 0.11 0.28 0.00 0.00 0.00 179.25 180.02 3iuh h VAL 158 N 0.68 1.12 -0.99 0.00 2.07 -0.31 -2.27 116.25 116.56 3iuh h VAL 158 Ca 0.14 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.37 3iuh h VAL 158 Cb 0.44 0.97 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 3iuh h VAL 158 CO 0.02 0.12 0.64 -0.08 0.02 0.00 0.00 177.57 178.28 3iuh h GLU 159 N 0.22 1.20 -0.43 1.57 4.57 -0.77 -0.78 114.58 120.15 3iuh h GLU 159 Ca 0.07 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3iuh h GLU 159 Cb 0.09 -0.27 -0.02 0.00 -0.16 0.00 0.00 28.75 28.39 3iuh h GLU 159 CO -0.01 0.79 0.26 1.25 -1.18 0.00 0.00 179.01 180.12 3iuh h HIS 160 N 1.23 0.57 -0.67 0.92 2.76 -1.01 -0.64 115.15 118.31 3iuh h HIS 160 Ca 0.40 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.52 3iuh h HIS 160 Cb 0.03 -0.19 -0.03 0.00 1.55 0.00 0.00 27.41 28.78 3iuh h HIS 160 CO -0.00 0.40 0.22 -0.91 -1.30 0.00 0.00 177.93 176.34 3iuh h ASN 161 N 0.57 0.94 -0.70 3.26 2.35 -0.82 -1.69 115.58 119.50 3iuh h ASN 161 Ca 0.15 -0.16 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 3iuh h ASN 161 Cb -0.01 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.09 3iuh h ASN 161 CO -0.03 0.87 0.30 -0.07 -1.65 0.00 0.00 177.43 176.86 3iuh h LEU 162 N 0.99 0.96 -1.04 1.61 3.38 -0.60 -1.77 115.31 118.84 3iuh h LEU 162 Ca 0.22 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 3iuh h LEU 162 Cb 0.26 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3iuh h LEU 162 CO -0.01 0.84 -0.01 -0.33 0.09 0.00 0.00 178.44 179.02 3iuh h GLU 163 N 1.04 0.67 -0.39 1.13 5.08 -0.56 -1.54 114.58 120.00 3iuh h GLU 163 Ca 0.24 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 3iuh h GLU 163 Cb 0.17 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3iuh h GLU 163 CO -0.02 0.69 0.07 0.00 -1.00 0.00 0.00 179.01 178.75 3iuh h ILE 165 N 0.57 1.27 -0.53 0.00 2.04 -0.71 -0.01 117.51 120.15 3iuh h ILE 165 Ca 0.13 -1.19 -0.01 0.00 1.00 0.00 0.00 64.86 64.79 3iuh h ILE 165 Cb 0.26 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 3iuh h ILE 165 CO 0.00 0.41 0.28 -0.33 0.00 0.00 0.00 178.15 178.51 3iuh h GLU 166 N 0.68 0.74 -0.47 2.37 4.39 -0.64 0.09 114.58 121.74 3iuh h GLU 166 Ca 0.11 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.68 3iuh h GLU 166 Cb 0.62 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.11 3iuh h GLU 166 CO 0.04 0.58 0.11 0.82 -1.16 0.00 0.00 179.01 179.41 3iuh h ILE 167 N 0.70 1.24 -0.52 3.13 2.04 -1.10 -2.89 117.51 120.11 3iuh h ILE 167 Ca 0.18 -0.83 0.01 0.00 1.00 0.00 0.00 64.86 65.22 3iuh h ILE 167 Cb 0.07 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 3iuh h ILE 167 CO -0.03 0.30 0.34 1.23 0.00 0.00 0.00 178.15 179.99 3iuh h GLY 168 N 0.63 0.73 1.30 5.37 0.00 -0.55 -2.42 103.07 108.12 3iuh h GLY 168 Ca 0.15 -0.27 0.03 0.00 0.00 0.00 0.00 47.33 47.24 3iuh h GLY 168 CO 0.00 0.26 0.40 0.50 0.00 0.00 0.00 176.54 177.71 3iuh h LYS 169 N 0.70 0.70 0.00 4.80 1.57 -0.91 0.11 116.57 123.54 3iuh h LYS 169 Ca 0.19 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.84 3iuh h LYS 169 Cb -0.08 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 3iuh h LYS 169 CO -0.04 0.46 -0.41 0.00 -0.57 0.00 0.00 179.45 178.89 3iuh h ALA 170 N 1.65 1.04 -0.02 3.86 0.00 -1.23 -3.25 119.26 121.31 3iuh h ALA 170 Ca 0.24 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3iuh h ALA 170 Cb 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3iuh h ALA 170 CO -0.07 0.51 -0.04 0.44 0.00 0.00 0.00 179.25 180.10 3iuh n ILE 171 N -3.64 0.00 -0.16 0.00 -5.35 -0.92 -4.83 119.36 104.47 3iuh n ILE 171 Ca -0.01 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 61.99 3iuh n ILE 171 Cb 0.51 1.33 0.00 0.00 -1.74 0.00 0.00 39.64 39.74 3iuh n ILE 171 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iuh n GLY 172 N 0.98 0.91 3.81 3.28 0.00 -0.67 -4.59 105.19 108.90 3iuh n GLY 172 Ca 0.09 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3iuh n GLY 172 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3iuh s SER 173 N -2.09 6.60 -0.10 1.61 0.15 0.30 -4.78 113.70 115.39 3iuh s SER 173 Ca 0.00 1.84 0.14 0.00 0.70 0.00 0.00 55.95 58.62 3iuh s SER 173 Cb 0.00 -2.55 0.23 0.00 -1.71 0.00 0.00 66.02 61.99 3iuh s SER 173 CO 0.00 -0.60 1.12 0.29 1.20 0.00 0.00 173.24 175.25 3iuh n LYS 174 N -0.79 0.94 -3.52 5.44 4.76 -1.26 -4.41 118.16 119.32 3iuh n LYS 174 Ca 0.08 -2.23 -0.10 0.00 -2.87 0.00 0.00 58.31 53.19 3iuh n LYS 174 Cb 0.53 -1.21 -0.03 0.00 -1.84 0.00 0.00 35.03 32.48 3iuh n LYS 174 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3iuh s ALA 175 N -2.09 -1.84 -0.13 7.82 0.00 -1.26 -2.64 121.76 121.62 3iuh s ALA 175 Ca 0.25 1.19 0.01 0.00 0.00 0.00 0.00 51.96 53.41 3iuh s ALA 175 Cb 0.22 0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.42 3iuh s ALA 175 CO 0.01 -0.55 -0.16 -1.17 0.00 0.00 0.00 175.76 173.89 3iuh s LEU 176 N -1.97 1.78 -0.22 0.00 2.96 -0.58 -0.43 118.68 120.22 3iuh s LEU 176 Ca 0.01 -0.48 -0.10 0.00 -0.22 0.00 0.00 54.13 53.35 3iuh s LEU 176 Cb -0.01 -1.18 -0.05 0.00 0.50 0.00 0.00 46.19 45.45 3iuh s LEU 176 CO -0.04 0.00 0.13 -0.89 -1.32 0.00 0.00 176.35 174.23 3iuh s THR 177 N 1.11 5.20 -0.27 3.68 2.01 0.11 -0.41 115.64 127.06 3iuh s THR 177 Ca -0.03 0.12 0.01 0.00 0.31 0.00 0.00 61.69 62.09 3iuh s THR 177 Cb -0.14 -3.39 0.05 0.00 0.01 0.00 0.00 72.50 69.03 3iuh s THR 177 CO -0.05 0.40 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.53 3iuh s VAL 178 N 0.75 2.55 -0.10 3.82 1.01 0.12 -2.69 120.40 125.86 3iuh s VAL 178 Ca 0.07 -1.48 0.01 0.00 0.00 0.00 0.00 61.98 60.58 3iuh s VAL 178 Cb -0.13 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.81 3iuh s VAL 178 CO 0.02 -0.03 -0.12 0.86 0.00 0.00 0.00 175.10 175.83 3iuh s TRP 179 N 1.18 1.65 0.23 5.22 -0.00 -1.26 -2.11 118.94 123.85 3iuh s TRP 179 Ca -0.07 -0.74 0.07 0.00 -0.00 0.00 0.00 56.10 55.36 3iuh s TRP 179 Cb -0.19 -1.25 -0.05 0.00 -0.00 0.00 0.00 33.47 31.98 3iuh s TRP 179 CO -0.04 -0.43 -0.10 0.96 -0.00 0.00 0.00 176.95 177.35 3iuh s ILE 180 N 1.11 1.60 -2.29 5.86 -4.36 -1.26 -4.68 121.20 117.18 3iuh s ILE 180 Ca -0.05 -2.15 0.26 0.00 -0.26 0.00 0.00 60.65 58.44 3iuh s ILE 180 Cb -0.14 -2.21 0.29 0.00 1.25 0.00 0.00 42.46 41.65 3iuh s ILE 180 CO -0.02 -0.47 1.47 0.61 0.24 0.00 0.00 174.94 176.76 3iuh n GLY 181 N -0.44 0.03 3.12 6.27 0.00 -1.26 -4.95 105.19 107.95 3iuh n GLY 181 Ca -0.07 -0.52 -0.54 0.00 0.00 0.00 0.00 46.02 44.89 3iuh n GLY 181 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3iuh n ASP 182 N 0.13 0.40 0.00 1.61 9.92 -1.26 -4.16 116.55 123.19 3iuh n ASP 182 Ca 0.14 1.02 0.00 0.00 -0.53 0.00 0.00 54.79 55.42 3iuh n ASP 182 Cb 0.42 -0.78 0.00 0.00 -0.64 0.00 0.00 41.12 40.12 3iuh n ASP 182 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3iuh n GLY 183 N 2.14 -0.57 3.17 0.44 0.00 -1.26 -2.00 105.19 107.11 3iuh n GLY 183 Ca 0.21 -0.87 -0.10 0.00 0.00 0.00 0.00 46.02 45.25 3iuh n GLY 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iuh s SER 184 N -4.00 0.97 0.00 1.61 1.04 -0.37 -4.86 113.70 108.09 3iuh s SER 184 Ca 0.00 -1.06 0.10 0.00 0.48 0.00 0.00 55.95 55.47 3iuh s SER 184 Cb 0.00 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.26 3iuh s SER 184 CO 0.00 -0.53 0.65 0.59 0.98 0.00 0.00 173.24 174.93 3iuh n ASN 185 N -0.06 1.27 -3.97 7.02 4.13 -1.26 -1.84 115.26 120.55 3iuh n ASN 185 Ca -0.11 -1.14 -0.11 0.00 1.68 0.00 0.00 54.58 54.90 3iuh n ASN 185 Cb 0.62 0.42 -0.12 0.00 -1.54 0.00 0.00 39.78 39.15 3iuh n ASN 185 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3iuh s PHE 186 N -1.29 0.31 0.38 3.10 0.40 -1.26 -4.47 117.98 115.15 3iuh s PHE 186 Ca 0.09 -0.36 -0.27 0.00 -0.60 0.00 0.00 56.93 55.78 3iuh s PHE 186 Cb 0.08 -0.21 -0.09 0.00 0.51 0.00 0.00 43.02 43.31 3iuh s PHE 186 CO 0.23 -0.11 1.30 -2.14 0.70 0.00 0.00 175.22 175.21 3iuh s PRO 187 N -1.03 4.12 0.00 0.24 0.02 -1.26 -2.21 135.00 134.87 3iuh s PRO 187 Ca -0.09 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.11 3iuh s PRO 187 Cb -0.07 -2.87 0.00 0.00 0.02 0.00 0.00 34.50 31.58 3iuh s PRO 187 CO -0.00 -0.38 0.00 0.41 -0.33 0.00 0.00 177.00 176.70 3iuh n GLY 188 N 0.70 2.87 0.20 0.52 0.00 -1.26 -4.87 105.19 103.35 3iuh n GLY 188 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.02 3iuh n GLY 188 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3iuh h GLN 189 N 0.52 0.11 -6.28 1.61 4.15 -1.88 -3.42 115.11 109.92 3iuh h GLN 189 Ca 0.00 -0.01 -0.59 0.00 0.77 0.00 0.00 58.65 58.82 3iuh h GLN 189 Cb 0.00 -0.02 -0.12 0.00 0.21 0.00 0.00 27.48 27.54 3iuh h GLN 189 CO 0.00 0.07 -0.71 -1.12 -1.93 0.00 0.00 178.83 175.14 3iuh s SER 190 N -5.25 4.12 -0.48 -0.69 0.01 -1.26 -5.08 113.70 105.06 3iuh s SER 190 Ca -0.13 -0.76 -0.13 0.00 1.31 0.00 0.00 55.95 56.23 3iuh s SER 190 Cb 0.17 -0.61 0.10 0.00 0.21 0.00 0.00 66.02 65.88 3iuh s SER 190 CO 0.72 0.04 0.39 0.21 0.41 0.00 0.00 173.24 175.02 3iuh s ASN 191 N -3.38 5.97 0.13 2.44 3.84 -1.26 -4.99 114.94 117.69 3iuh s ASN 191 Ca 0.29 -1.64 -0.22 0.00 0.21 0.00 0.00 52.86 51.51 3iuh s ASN 191 Cb -0.07 -2.12 -0.01 0.00 -0.55 0.00 0.00 41.25 38.51 3iuh s ASN 191 CO 0.17 -0.70 1.17 0.49 -2.79 0.00 0.00 177.10 175.44 3iuh n PHE 192 N 5.10 -0.27 -0.09 0.43 3.72 -1.26 -1.08 117.46 124.01 3iuh n PHE 192 Ca -0.11 0.95 -0.10 0.00 -0.05 0.00 0.00 57.45 58.13 3iuh n PHE 192 Cb 0.42 -0.60 -0.03 0.00 -0.94 0.00 0.00 39.48 38.32 3iuh n PHE 192 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 3iuh h THR 193 N 0.00 1.21 -0.58 4.37 2.02 -1.99 -2.31 112.91 115.62 3iuh h THR 193 Ca 0.15 -0.67 -0.03 0.00 0.77 0.00 0.00 66.41 66.62 3iuh h THR 193 Cb 0.34 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 3iuh h THR 193 CO -0.72 0.22 0.22 0.03 0.37 0.00 0.00 175.52 175.64 3iuh h ARG 194 N 0.27 0.87 -0.86 6.66 3.08 -1.76 0.11 114.38 122.75 3iuh h ARG 194 Ca 0.09 -0.16 0.02 0.00 0.07 0.00 0.00 59.98 60.00 3iuh h ARG 194 Cb 0.26 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.13 3iuh h ARG 194 CO -0.00 0.75 0.56 0.00 -1.07 0.00 0.00 179.97 180.21 3iuh h ALA 195 N 1.07 1.11 -0.46 0.04 0.00 -1.07 -0.23 119.26 119.73 3iuh h ALA 195 Ca 0.19 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 3iuh h ALA 195 Cb 0.21 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3iuh h ALA 195 CO -0.01 0.44 -0.21 0.35 0.00 0.00 0.00 179.25 179.82 3iuh h PHE 196 N 1.12 1.05 -0.74 0.00 3.57 -0.95 -1.32 116.94 119.66 3iuh h PHE 196 Ca 0.33 -0.24 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 3iuh h PHE 196 Cb -0.06 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.40 3iuh h PHE 196 CO -0.02 1.03 0.44 0.93 -2.23 0.00 0.00 178.31 178.47 3iuh h GLU 197 N 0.80 1.01 -0.49 1.11 5.08 0.05 0.43 114.58 122.57 3iuh h GLU 197 Ca 0.11 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 3iuh h GLU 197 Cb 0.76 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 3iuh h GLU 197 CO 0.06 0.72 0.03 0.00 -1.00 0.00 0.00 179.01 178.83 3iuh h ARG 198 N 1.01 0.84 -0.40 2.33 3.08 -0.86 -2.30 114.38 118.08 3iuh h ARG 198 Ca 0.27 -0.25 0.02 0.00 0.07 0.00 0.00 59.98 60.08 3iuh h ARG 198 Cb -0.02 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 3iuh h ARG 198 CO -0.05 0.86 0.24 -0.92 -1.07 0.00 0.00 179.97 179.03 3iuh h TYR 199 N 0.70 0.44 -0.68 3.04 5.03 -0.67 -2.01 116.97 122.83 3iuh h TYR 199 Ca 0.14 0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.49 3iuh h TYR 199 Cb 0.46 -0.14 -0.04 0.00 1.55 0.00 0.00 36.73 38.56 3iuh h TYR 199 CO 0.03 0.25 0.43 -0.07 -1.32 0.00 0.00 178.16 177.49 3iuh h LEU 200 N 0.48 0.73 -0.81 2.82 3.38 -0.76 -1.22 115.31 119.93 3iuh h LEU 200 Ca 0.16 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 3iuh h LEU 200 Cb 0.01 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3iuh h LEU 200 CO -0.08 0.51 -0.01 -1.28 0.09 0.00 0.00 178.44 177.67 3iuh h SER 201 N 0.86 0.85 -0.27 -0.43 0.87 -1.13 -1.26 113.55 113.04 3iuh h SER 201 Ca 0.26 -0.22 -0.09 0.00 -1.23 0.00 0.00 61.79 60.50 3iuh h SER 201 Cb -0.03 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 3iuh h SER 201 CO -0.08 0.92 -0.19 0.00 -0.53 0.00 0.00 176.83 176.95 3iuh h ALA 202 N 1.17 0.39 -0.01 6.23 0.00 -1.08 -2.70 119.26 123.25 3iuh h ALA 202 Ca 0.15 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3iuh h ALA 202 Cb 0.50 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3iuh h ALA 202 CO 0.03 0.32 -0.13 0.52 0.00 0.00 0.00 179.25 179.98 3iuh h MET 203 N 0.34 0.01 -0.63 0.00 2.07 -1.09 -1.14 114.93 114.49 3iuh h MET 203 Ca 0.05 -0.00 -0.07 0.00 -2.07 0.00 0.00 59.70 57.61 3iuh h MET 203 Cb 0.73 -0.00 -0.03 0.00 -1.87 0.00 0.00 31.60 30.43 3iuh h MET 203 CO 0.05 0.15 0.10 0.00 1.07 0.00 0.00 176.91 178.28 3iuh h ALA 204 N 1.85 0.99 -0.27 6.32 0.00 -0.96 0.16 119.26 127.35 3iuh h ALA 204 Ca 0.00 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 3iuh h ALA 204 Cb 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3iuh h ALA 204 CO 0.02 0.64 -0.01 0.93 0.00 0.00 0.00 179.25 180.83 3iuh h GLU 205 N 0.97 0.48 -0.52 0.00 5.08 -0.94 -1.39 114.58 118.26 3iuh h GLU 205 Ca 0.19 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3iuh h GLU 205 Cb 0.42 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 3iuh h GLU 205 CO 0.01 0.65 0.34 0.82 -1.00 0.00 0.00 179.01 179.83 3iuh h ILE 206 N 0.26 1.14 -0.59 3.13 2.04 -1.05 -1.89 117.51 120.55 3iuh h ILE 206 Ca 0.08 -0.26 0.04 0.00 1.00 0.00 0.00 64.86 65.71 3iuh h ILE 206 Cb 0.44 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 3iuh h ILE 206 CO 0.02 0.13 0.39 0.22 0.00 0.00 0.00 178.15 178.91 3iuh h TYR 207 N 0.71 0.65 0.00 1.37 5.03 -0.51 -0.92 116.97 123.29 3iuh h TYR 207 Ca 0.19 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.49 3iuh h TYR 207 Cb -0.07 -0.22 -0.00 0.00 1.55 0.00 0.00 36.73 37.99 3iuh h TYR 207 CO -0.04 0.37 -0.12 0.87 -1.32 0.00 0.00 178.16 177.93 3iuh h LYS 208 N 0.67 0.00 -0.65 1.82 1.57 -0.41 -2.13 116.57 117.43 3iuh h LYS 208 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3iuh h LYS 208 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 3iuh h LYS 208 CO -0.07 0.12 0.00 0.41 -0.57 0.00 0.00 179.45 179.34 3iuh n GLY 209 N -1.07 2.39 3.73 3.86 0.00 -0.36 -4.93 105.19 108.82 3iuh n GLY 209 Ca -0.02 -0.68 -0.40 0.00 0.00 0.00 0.00 46.02 44.91 3iuh n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3iuh s LEU 210 N -1.83 4.37 0.76 0.99 1.43 -0.80 -5.02 118.68 118.58 3iuh s LEU 210 Ca 0.41 1.27 -0.12 0.00 -1.03 0.00 0.00 54.13 54.66 3iuh s LEU 210 Cb 0.29 -3.11 0.06 0.00 0.03 0.00 0.00 46.19 43.45 3iuh s LEU 210 CO 0.16 -0.05 1.11 -2.84 0.23 0.00 0.00 176.35 174.96 3iuh s PRO 211 N 0.41 2.18 0.00 1.29 0.02 -1.26 -4.87 135.00 132.77 3iuh s PRO 211 Ca 0.37 1.33 0.20 0.00 0.02 0.00 0.00 61.00 62.92 3iuh s PRO 211 Cb -0.19 -1.88 1.00 0.00 0.02 0.00 0.00 34.50 33.45 3iuh s PRO 211 CO 0.20 -1.72 1.62 -0.25 -0.33 0.00 0.00 177.00 176.52 3iuh n ASP 212 N -3.30 0.00 -0.77 2.53 8.00 -1.26 -1.90 116.55 119.85 3iuh n ASP 212 Ca 0.10 0.04 0.07 0.00 0.71 0.00 0.00 54.79 55.70 3iuh n ASP 212 Cb 0.52 -0.30 0.19 0.00 -0.02 0.00 0.00 41.12 41.51 3iuh n ASP 212 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3iuh n ASP 213 N -1.30 3.14 -4.88 -2.24 3.85 -1.26 -4.98 116.55 108.87 3iuh n ASP 213 Ca 0.09 -2.02 -0.21 0.00 -0.71 0.00 0.00 54.79 51.93 3iuh n ASP 213 Cb 0.16 -0.28 -0.03 0.00 -1.35 0.00 0.00 41.12 39.62 3iuh n ASP 213 CO 0.00 0.00 0.00 0.26 -1.01 0.00 0.00 177.20 176.45 3iuh s TRP 214 N -1.04 3.15 0.08 2.11 0.52 -0.80 -4.89 118.94 118.06 3iuh s TRP 214 Ca 0.28 -0.14 0.05 0.00 0.02 0.00 0.00 56.10 56.32 3iuh s TRP 214 Cb 0.15 -1.59 -0.03 0.00 -1.15 0.00 0.00 33.47 30.85 3iuh s TRP 214 CO 0.19 0.37 -0.15 0.15 0.02 0.00 0.00 176.95 177.53 3iuh s LYS 215 N -3.94 0.87 -0.29 4.98 1.02 -1.08 -4.83 119.74 116.47 3iuh s LYS 215 Ca 0.36 -1.01 -0.02 0.00 0.02 0.00 0.00 55.97 55.32 3iuh s LYS 215 Cb -0.08 -0.89 0.04 0.00 -0.52 0.00 0.00 37.83 36.39 3iuh s LYS 215 CO 0.27 0.19 -0.01 -1.17 -0.92 0.00 0.00 175.35 173.71 3iuh s LEU 216 N -1.85 3.74 -0.20 3.17 2.96 0.13 -1.53 118.68 125.10 3iuh s LEU 216 Ca 0.00 -1.18 -0.11 0.00 -0.22 0.00 0.00 54.13 52.62 3iuh s LEU 216 Cb -0.09 -1.70 -0.05 0.00 0.50 0.00 0.00 46.19 44.85 3iuh s LEU 216 CO 0.02 -0.23 0.16 -0.36 -1.32 0.00 0.00 176.35 174.63 3iuh s PHE 217 N 1.27 3.40 -0.05 5.38 0.08 0.45 -1.31 117.98 127.20 3iuh s PHE 217 Ca -0.04 0.36 0.01 0.00 0.12 0.00 0.00 56.93 57.37 3iuh s PHE 217 Cb -0.19 -2.21 -0.03 0.00 -0.57 0.00 0.00 43.02 40.02 3iuh s PHE 217 CO -0.02 0.25 -0.04 -1.54 -0.10 0.00 0.00 175.22 173.77 3iuh s SER 218 N 0.49 4.90 -0.15 1.36 1.04 -0.82 0.12 113.70 120.64 3iuh s SER 218 Ca 0.09 0.01 0.01 0.00 0.48 0.00 0.00 55.95 56.54 3iuh s SER 218 Cb -0.12 -1.27 0.02 0.00 0.10 0.00 0.00 66.02 64.75 3iuh s SER 218 CO -0.00 0.34 -0.16 -0.70 0.98 0.00 0.00 173.24 173.70 3iuh s GLU 219 N -1.05 2.44 0.40 4.02 2.12 -0.90 -1.02 118.70 124.71 3iuh s GLU 219 Ca 0.15 -0.62 -0.11 0.00 0.36 0.00 0.00 54.97 54.75 3iuh s GLU 219 Cb -0.11 -2.16 -0.07 0.00 0.26 0.00 0.00 34.13 32.05 3iuh s GLU 219 CO 0.04 -0.19 0.77 -3.38 -0.54 0.00 0.00 175.26 171.96 3iuh s HIS 220 N 1.34 3.46 -0.19 5.30 -3.43 -1.26 -4.70 115.29 115.81 3iuh s HIS 220 Ca 0.03 1.07 -0.12 0.00 -0.80 0.00 0.00 55.06 55.23 3iuh s HIS 220 Cb -0.13 -2.46 0.06 0.00 -1.43 0.00 0.00 32.58 28.62 3iuh s HIS 220 CO -0.09 -0.09 0.48 0.21 -2.00 0.00 0.00 174.74 173.24 3iuh s LYS 221 N -3.77 0.49 0.22 -0.38 2.20 -0.06 -4.74 119.74 113.69 3iuh s LYS 221 Ca 0.52 0.85 -0.06 0.00 -0.36 0.00 0.00 55.97 56.92 3iuh s LYS 221 Cb -0.10 0.07 0.19 0.00 -1.51 0.00 0.00 37.83 36.47 3iuh s LYS 221 CO 0.30 -0.14 1.72 1.98 -0.36 0.00 0.00 175.35 178.85 3iuh h MET 222 N 6.76 1.01 -2.25 4.03 1.85 -0.94 -3.32 114.93 122.07 3iuh h MET 222 Ca -0.34 -0.26 0.16 0.00 -0.61 0.00 0.00 59.70 58.65 3iuh h MET 222 Cb 1.19 -0.12 -0.12 0.00 0.43 0.00 0.00 31.60 32.98 3iuh h MET 222 CO 0.25 0.94 0.51 1.52 -0.40 0.00 0.00 176.91 179.74 3iuh s TYR 223 N -5.16 -0.22 0.00 1.39 1.13 -1.26 -4.54 117.35 108.69 3iuh s TYR 223 Ca -0.11 0.00 0.00 0.00 -1.41 0.00 0.00 57.07 55.55 3iuh s TYR 223 Cb 0.15 0.59 0.00 0.00 -1.10 0.00 0.00 41.96 41.59 3iuh s TYR 223 CO 0.84 -0.66 0.00 -1.91 -2.51 0.00 0.00 175.55 171.31 3iuh n GLU 224 N -0.37 0.00 0.11 -3.49 2.13 -1.26 -4.83 120.64 112.93 3iuh n GLU 224 Ca -0.07 0.46 0.11 0.00 0.66 0.00 0.00 57.16 58.32 3iuh n GLU 224 Cb 0.61 -0.00 0.46 0.00 0.27 0.00 0.00 31.44 32.78 3iuh n GLU 224 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 3iuh n PRO 225 N 0.27 0.17 -2.84 5.31 -0.04 -1.26 -4.95 135.00 131.65 3iuh n PRO 225 Ca 0.00 0.39 -0.41 0.00 -0.04 0.00 0.00 63.50 63.44 3iuh n PRO 225 Cb 0.00 -1.81 -0.04 0.00 -0.04 0.00 0.00 33.50 31.61 3iuh n PRO 225 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3iuh s ALA 226 N -3.26 3.26 -0.35 0.55 0.00 -1.26 -4.97 121.76 115.73 3iuh s ALA 226 Ca 0.05 0.41 0.15 0.00 0.00 0.00 0.00 51.96 52.57 3iuh s ALA 226 Cb 0.09 -3.17 0.48 0.00 0.00 0.00 0.00 23.12 20.52 3iuh s ALA 226 CO 0.38 -0.09 1.38 1.19 0.00 0.00 0.00 175.76 178.62 3iuh n PHE 227 N 3.39 0.83 0.01 0.00 3.72 -1.21 -4.58 117.46 119.61 3iuh n PHE 227 Ca 0.02 -0.79 0.00 0.00 -0.05 0.00 0.00 57.45 56.63 3iuh n PHE 227 Cb 0.50 -0.25 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 3iuh n PHE 227 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 3iuh n TYR 228 N -0.28 -0.19 -3.89 1.38 9.36 -0.76 -4.93 117.16 117.85 3iuh n TYR 228 Ca 0.19 0.03 -0.10 0.00 3.32 0.00 0.00 57.90 61.34 3iuh n TYR 228 Cb 0.78 0.30 -0.09 0.00 -0.63 0.00 0.00 39.34 39.70 3iuh n TYR 228 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 3iuh s SER 229 N -5.05 0.09 -0.03 2.98 1.04 -0.89 -4.99 113.70 106.85 3iuh s SER 229 Ca 0.00 -0.40 0.01 0.00 0.48 0.00 0.00 55.95 56.04 3iuh s SER 229 Cb 0.00 0.24 0.02 0.00 0.10 0.00 0.00 66.02 66.38 3iuh s SER 229 CO 0.00 -0.49 -0.03 -0.89 0.98 0.00 0.00 173.24 172.81 3iuh s THR 230 N -2.27 0.36 0.12 2.02 2.01 -1.26 -1.23 115.64 115.38 3iuh s THR 230 Ca -0.08 -0.07 -0.29 0.00 0.31 0.00 0.00 61.69 61.57 3iuh s THR 230 Cb -0.03 -0.38 -0.08 0.00 0.01 0.00 0.00 72.50 72.02 3iuh s THR 230 CO -0.03 0.16 1.61 0.58 -0.69 0.00 0.00 174.62 176.25 3iuh h VAL 231 N 5.87 0.26 -3.05 3.82 2.07 -1.74 -2.83 116.25 120.66 3iuh h VAL 231 Ca -0.37 0.00 -0.80 0.00 0.82 0.00 0.00 66.70 66.35 3iuh h VAL 231 Cb 1.16 0.26 -0.29 0.00 -1.52 0.00 0.00 31.29 30.90 3iuh h VAL 231 CO 0.48 0.00 0.66 0.52 0.02 0.00 0.00 177.57 179.25 3iuh n VAL 232 N -5.43 5.05 0.08 2.57 0.31 -1.26 -4.82 118.33 114.81 3iuh n VAL 232 Ca -0.06 -5.78 -0.09 0.00 -0.01 0.00 0.00 64.34 58.40 3iuh n VAL 232 Cb 0.35 -2.20 -0.10 0.00 -0.91 0.00 0.00 33.84 30.98 3iuh n VAL 232 CO 0.00 0.00 0.00 0.06 -1.32 0.00 0.00 176.83 175.57 3iuh h GLN 233 N 5.68 0.08 -4.05 5.55 -0.00 -1.60 -0.13 115.11 120.63 3iuh h GLN 233 Ca 0.19 -0.12 -0.23 0.00 -0.00 0.00 0.00 58.65 58.50 3iuh h GLN 233 Cb 0.68 0.04 -0.09 0.00 -0.00 0.00 0.00 27.48 28.11 3iuh h GLN 233 CO 1.24 1.03 -0.20 0.16 -0.00 0.00 0.00 178.83 181.06 3iuh s ASP 234 N -6.83 0.65 0.56 0.06 1.47 -1.26 -2.17 116.67 109.14 3iuh s ASP 234 Ca -0.01 -1.37 0.30 0.00 1.18 0.00 0.00 52.55 52.66 3iuh s ASP 234 Cb 0.09 0.63 1.66 0.00 -0.34 0.00 0.00 42.92 44.96 3iuh s ASP 234 CO 0.83 -1.24 2.15 4.11 0.68 0.00 0.00 175.17 181.71 3iuh h TRP 235 N 2.17 0.00 0.19 2.11 5.08 -1.94 -0.96 115.95 122.60 3iuh h TRP 235 Ca -0.28 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.68 3iuh h TRP 235 Cb 1.24 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.40 3iuh h TRP 235 CO 1.19 0.07 -0.09 0.78 -1.28 0.00 0.00 178.44 179.10 3iuh h GLY 236 N 0.57 -0.27 1.04 11.11 0.00 -1.99 0.27 103.07 113.80 3iuh h GLY 236 Ca -0.00 0.10 -0.04 0.00 0.00 0.00 0.00 47.33 47.39 3iuh h GLY 236 CO 0.01 -0.10 0.34 -0.84 0.00 0.00 0.00 176.54 175.95 3iuh h THR 237 N -0.52 1.26 -0.68 4.70 2.02 -1.86 -2.50 112.91 115.33 3iuh h THR 237 Ca -0.03 -0.77 0.04 0.00 0.77 0.00 0.00 66.41 66.42 3iuh h THR 237 Cb 0.39 0.30 -0.05 0.00 -1.74 0.00 0.00 68.15 67.06 3iuh h THR 237 CO 0.04 0.32 0.41 -1.13 0.37 0.00 0.00 175.52 175.53 3iuh h ASN 238 N 1.13 0.64 -0.45 4.18 -0.00 -0.97 -1.26 115.58 118.85 3iuh h ASN 238 Ca 0.27 0.01 -0.01 0.00 -0.00 0.00 0.00 56.30 56.57 3iuh h ASN 238 Cb 0.18 -0.12 -0.02 0.00 -0.00 0.00 0.00 38.32 38.36 3iuh h ASN 238 CO -0.03 0.43 0.25 0.22 -0.00 0.00 0.00 177.43 178.31 3iuh h TYR 239 N 0.77 0.62 -0.95 0.67 3.20 -0.11 -1.26 116.97 119.91 3iuh h TYR 239 Ca 0.29 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.22 3iuh h TYR 239 Cb 0.09 -0.20 -0.07 0.00 1.54 0.00 0.00 36.73 38.10 3iuh h TYR 239 CO -0.06 0.47 0.61 -0.07 -1.64 0.00 0.00 178.16 177.47 3iuh h LEU 240 N 0.60 0.94 0.48 2.82 3.38 -0.97 0.11 115.31 122.67 3iuh h LEU 240 Ca 0.16 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 3iuh h LEU 240 Cb 0.05 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3iuh h LEU 240 CO -0.03 0.58 -0.23 0.40 0.09 0.00 0.00 178.44 179.25 3iuh h ILE 241 N 1.05 0.52 -0.66 1.22 2.04 -0.55 -1.01 117.51 120.13 3iuh h ILE 241 Ca 0.42 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 66.13 3iuh h ILE 241 Cb 0.27 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3iuh h ILE 241 CO -0.18 0.03 0.43 0.00 0.00 0.00 0.00 178.15 178.44 3iuh h ALA 242 N -0.26 0.83 -0.65 1.87 0.00 -0.83 -0.94 119.26 119.28 3iuh h ALA 242 Ca -0.07 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 3iuh h ALA 242 Cb 0.54 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3iuh h ALA 242 CO 0.11 0.26 0.19 0.37 0.00 0.00 0.00 179.25 180.18 3iuh h GLN 243 N 0.89 1.00 -0.12 0.00 5.75 -0.74 -2.57 115.11 119.31 3iuh h GLN 243 Ca 0.24 -0.20 -0.17 0.00 -0.15 0.00 0.00 58.65 58.37 3iuh h GLN 243 Cb -0.10 -0.15 0.01 0.00 1.07 0.00 0.00 27.48 28.31 3iuh h GLN 243 CO -0.05 0.86 -0.58 1.15 -2.65 0.00 0.00 178.83 177.56 3iuh h THR 244 N 0.96 1.34 -0.39 2.39 2.02 -0.84 -3.34 112.91 115.04 3iuh h THR 244 Ca 0.21 -1.86 -0.07 0.00 0.77 0.00 0.00 66.41 65.46 3iuh h THR 244 Cb 0.29 2.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.79 3iuh h THR 244 CO -0.01 0.57 -0.04 -0.07 0.37 0.00 0.00 175.52 176.34 3iuh h LEU 245 N 0.26 0.72 0.00 2.58 3.38 -1.12 -3.50 115.31 117.63 3iuh h LEU 245 Ca -0.04 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3iuh h LEU 245 Cb 1.22 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.78 3iuh h LEU 245 CO 0.12 0.88 0.00 0.61 0.09 0.00 0.00 178.44 180.14 3iuh n GLY 246 N -0.29 2.00 0.41 0.83 0.00 -0.98 -4.91 105.19 102.26 3iuh n GLY 246 Ca -0.01 -1.89 0.23 0.00 0.00 0.00 0.00 46.02 44.34 3iuh n GLY 246 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3iuh h PRO 247 N 0.00 0.00 -0.01 1.61 0.11 -1.91 -0.78 132.00 131.02 3iuh h PRO 247 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3iuh h PRO 247 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3iuh h PRO 247 CO 0.00 0.00 -0.16 1.63 -0.21 0.00 0.00 178.00 179.26 3iuh n LYS 248 N -4.05 0.74 -3.82 1.05 5.02 -1.26 -4.82 118.16 111.02 3iuh n LYS 248 Ca 0.11 -0.33 -0.35 0.00 -2.02 0.00 0.00 58.31 55.73 3iuh n LYS 248 Cb 0.71 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 34.15 3iuh n LYS 248 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3iuh s ALA 249 N -2.48 3.60 0.25 7.82 0.00 -0.30 0.18 121.76 130.83 3iuh s ALA 249 Ca 0.27 -0.71 0.02 0.00 0.00 0.00 0.00 51.96 51.54 3iuh s ALA 249 Cb 0.20 -2.08 -0.04 0.00 0.00 0.00 0.00 23.12 21.19 3iuh s ALA 249 CO 0.49 0.17 0.17 -0.65 0.00 0.00 0.00 175.76 175.94 3iuh s GLN 250 N 0.35 1.42 -0.11 0.00 -0.21 -0.43 -4.75 119.66 115.92 3iuh s GLN 250 Ca 0.06 -1.78 -0.03 0.00 0.02 0.00 0.00 55.36 53.63 3iuh s GLN 250 Cb -0.11 0.20 -0.03 0.00 1.00 0.00 0.00 33.01 34.07 3iuh s GLN 250 CO -0.01 -0.46 0.02 0.00 -2.12 0.00 0.00 175.29 172.71 3iuh s LEU 252 N -0.59 4.25 -0.30 0.00 1.43 -0.19 -0.32 118.68 122.95 3iuh s LEU 252 Ca 0.10 0.34 -0.05 0.00 -1.03 0.00 0.00 54.13 53.50 3iuh s LEU 252 Cb -0.12 -2.06 0.03 0.00 0.03 0.00 0.00 46.19 44.07 3iuh s LEU 252 CO 0.02 0.31 0.04 -0.69 0.23 0.00 0.00 176.35 176.26 3iuh s VAL 253 N -0.41 3.49 -0.32 -1.59 1.01 -0.35 -4.11 120.40 118.11 3iuh s VAL 253 Ca 0.11 -1.03 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 3iuh s VAL 253 Cb -0.12 -2.89 -0.02 0.00 0.00 0.00 0.00 36.38 33.35 3iuh s VAL 253 CO 0.01 -0.01 0.21 -0.62 0.00 0.00 0.00 175.10 174.70 3iuh s ASP 254 N 1.38 5.97 0.25 3.32 -1.08 -1.26 0.13 116.67 125.38 3iuh s ASP 254 Ca -0.01 -0.32 -0.11 0.00 -0.52 0.00 0.00 52.55 51.59 3iuh s ASP 254 Cb -0.18 -2.11 0.35 0.00 -1.46 0.00 0.00 42.92 39.52 3iuh s ASP 254 CO 0.00 -0.18 1.58 0.25 0.52 0.00 0.00 175.17 177.35 3iuh h LEU 255 N 8.44 -0.85 -0.37 -1.34 6.46 -1.76 -0.92 115.31 124.97 3iuh h LEU 255 Ca -0.32 0.26 0.00 0.00 -0.12 0.00 0.00 57.88 57.69 3iuh h LEU 255 Cb 1.16 0.55 0.00 0.00 -0.73 0.00 0.00 40.66 41.64 3iuh h LEU 255 CO 0.61 -0.28 0.00 0.61 -0.62 0.00 0.00 178.44 178.75 3iuh n GLY 256 N -1.54 -0.18 1.79 3.75 0.00 -1.26 -4.00 105.19 103.74 3iuh n GLY 256 Ca 0.12 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.20 3iuh n GLY 256 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3iuh n HIS 257 N -0.30 1.87 -4.30 1.61 8.25 -0.35 -3.28 115.22 118.72 3iuh n HIS 257 Ca 0.01 -0.68 -0.24 0.00 -0.26 0.00 0.00 57.72 56.55 3iuh n HIS 257 Cb 0.09 -0.41 -0.08 0.00 1.12 0.00 0.00 29.99 30.71 3iuh n HIS 257 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3iuh s HIS 258 N -2.42 2.59 0.85 4.41 3.76 -1.26 -2.20 115.29 121.02 3iuh s HIS 258 Ca 0.54 -0.35 -0.11 0.00 -0.15 0.00 0.00 55.06 54.98 3iuh s HIS 258 Cb 0.39 -1.37 0.11 0.00 1.11 0.00 0.00 32.58 32.81 3iuh s HIS 258 CO 0.19 0.52 1.15 0.00 -0.85 0.00 0.00 174.74 175.76 3iuh s ALA 259 N -2.45 1.75 0.27 -1.40 0.00 -1.26 -4.90 121.76 113.77 3iuh s ALA 259 Ca 0.34 0.61 -0.30 0.00 0.00 0.00 0.00 51.96 52.60 3iuh s ALA 259 Cb -0.03 -3.43 -0.13 0.00 0.00 0.00 0.00 23.12 19.54 3iuh s ALA 259 CO 0.20 -2.40 1.39 -2.30 0.00 0.00 0.00 175.76 172.65 3iuh n PRO 260 N -3.77 2.11 -1.00 0.00 -0.02 -1.26 -2.18 135.00 128.88 3iuh n PRO 260 Ca 0.12 0.75 -0.00 0.00 -2.02 0.00 0.00 63.50 62.35 3iuh n PRO 260 Cb 0.52 -2.40 -0.00 0.00 -0.02 0.00 0.00 33.50 31.60 3iuh n PRO 260 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3iuh n ASN 261 N 1.83 -4.62 -4.76 2.55 3.02 -1.26 -4.99 115.26 107.02 3iuh n ASN 261 Ca 0.10 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.24 3iuh n ASN 261 Cb 0.33 -2.13 0.01 0.00 -0.61 0.00 0.00 39.78 37.38 3iuh n ASN 261 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3iuh n THR 262 N -2.46 2.51 -2.93 3.41 -1.04 -0.92 -4.90 114.28 107.94 3iuh n THR 262 Ca -0.00 -0.50 -0.44 0.00 -2.04 0.00 0.00 64.05 61.07 3iuh n THR 262 Cb 0.27 -1.86 -0.03 0.00 -1.82 0.00 0.00 70.33 66.89 3iuh n THR 262 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 3iuh s ASN 263 N -0.36 6.47 0.17 8.00 3.84 -1.26 -4.86 114.94 126.94 3iuh s ASN 263 Ca 0.58 -1.73 -0.08 0.00 0.21 0.00 0.00 52.86 51.84 3iuh s ASN 263 Cb -0.46 -2.39 0.04 0.00 -0.55 0.00 0.00 41.25 37.89 3iuh s ASN 263 CO 0.60 -1.16 1.53 0.40 -2.79 0.00 0.00 177.10 175.68 3iuh h ILE 264 N 5.86 1.28 -0.22 -5.21 2.04 -1.98 -3.03 117.51 116.25 3iuh h ILE 264 Ca -0.00 -1.49 -0.00 0.00 1.00 0.00 0.00 64.86 64.36 3iuh h ILE 264 Cb 1.04 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 38.44 3iuh h ILE 264 CO 1.12 0.50 0.12 1.05 0.00 0.00 0.00 178.15 180.94 3iuh h GLU 265 N 0.73 0.29 -0.43 2.37 9.09 -1.90 -0.83 114.58 123.89 3iuh h GLU 265 Ca 0.07 -0.02 -0.10 0.00 0.05 0.00 0.00 59.36 59.36 3iuh h GLU 265 Cb 0.90 -0.06 -0.02 0.00 -1.65 0.00 0.00 28.75 27.92 3iuh h GLU 265 CO 0.08 0.22 -0.15 1.98 0.05 0.00 0.00 179.01 181.19 3iuh h MET 266 N 0.30 0.82 -0.86 1.06 4.05 -1.92 -1.66 114.93 116.72 3iuh h MET 266 Ca 0.08 -0.30 -0.01 0.00 -0.28 0.00 0.00 59.70 59.19 3iuh h MET 266 Cb 0.01 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 30.71 3iuh h MET 266 CO -0.01 0.92 0.48 0.82 0.23 0.00 0.00 176.91 179.35 3iuh h ILE 267 N 0.73 1.25 -0.42 1.77 2.04 -1.11 -0.44 117.51 121.33 3iuh h ILE 267 Ca 0.11 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 3iuh h ILE 267 Cb 0.66 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 3iuh h ILE 267 CO 0.05 0.27 0.24 0.58 0.00 0.00 0.00 178.15 179.29 3iuh h VAL 268 N 1.19 1.15 -0.16 1.67 2.07 -1.00 -1.60 116.25 119.56 3iuh h VAL 268 Ca 0.30 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3iuh h VAL 268 Cb 0.01 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 3iuh h VAL 268 CO -0.05 0.15 0.10 0.00 0.02 0.00 0.00 177.57 177.79 3iuh h ALA 269 N 1.10 0.20 -0.11 1.67 0.00 -0.84 -1.51 119.26 119.76 3iuh h ALA 269 Ca 0.15 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.06 3iuh h ALA 269 Cb 0.03 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3iuh h ALA 269 CO -0.03 -0.31 -0.06 0.00 0.00 0.00 0.00 179.25 178.85 3iuh h ARG 270 N 0.20 -0.06 -0.98 0.00 2.47 -0.87 -0.61 114.38 114.53 3iuh h ARG 270 Ca 0.06 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.79 3iuh h ARG 270 Cb -0.00 0.01 -0.05 0.00 -1.65 0.00 0.00 29.97 28.28 3iuh h ARG 270 CO -0.01 -0.04 0.64 -0.07 0.56 0.00 0.00 179.97 181.05 3iuh h LEU 271 N -0.06 1.13 -0.06 3.04 3.38 -1.18 -2.34 115.31 119.22 3iuh h LEU 271 Ca 0.07 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3iuh h LEU 271 Cb 0.16 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 3iuh h LEU 271 CO -0.15 0.82 0.02 0.40 0.09 0.00 0.00 178.44 179.62 3iuh h ILE 272 N 1.33 1.13 -0.89 1.22 2.04 -0.81 0.16 117.51 121.68 3iuh h ILE 272 Ca 0.36 -0.38 0.16 0.00 1.00 0.00 0.00 64.86 65.99 3iuh h ILE 272 Cb -0.14 1.28 -0.07 0.00 -0.74 0.00 0.00 36.82 37.15 3iuh h ILE 272 CO -0.08 0.11 0.58 -0.61 0.00 0.00 0.00 178.15 178.15 3iuh h GLN 273 N -0.06 0.62 -0.60 2.37 4.15 -0.78 0.32 115.11 121.13 3iuh h GLN 273 Ca 0.02 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.40 3iuh h GLN 273 Cb 0.15 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.70 3iuh h GLN 273 CO -0.00 0.41 0.00 1.19 -1.93 0.00 0.00 178.83 178.50 3iuh n PHE 274 N -4.56 1.80 -3.84 3.99 3.72 -0.91 -4.97 117.46 112.69 3iuh n PHE 274 Ca 0.18 -0.68 -0.30 0.00 -0.05 0.00 0.00 57.45 56.60 3iuh n PHE 274 Cb 0.51 -0.39 0.02 0.00 -0.94 0.00 0.00 39.48 38.68 3iuh n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3iuh n GLY 275 N 0.82 -0.50 0.16 1.37 0.00 0.10 -4.90 105.19 102.24 3iuh n GLY 275 Ca 0.27 0.18 0.07 0.00 0.00 0.00 0.00 46.02 46.54 3iuh n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3iuh n LYS 276 N -4.57 1.11 -2.90 1.61 4.76 0.44 -4.95 118.16 113.67 3iuh n LYS 276 Ca 0.04 -2.06 -0.43 0.00 -2.87 0.00 0.00 58.31 52.98 3iuh n LYS 276 Cb 0.53 -1.20 -0.03 0.00 -1.84 0.00 0.00 35.03 32.48 3iuh n LYS 276 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3iuh s LEU 277 N -1.97 4.66 0.17 -0.35 2.96 -1.21 0.23 118.68 123.17 3iuh s LEU 277 Ca 0.21 -1.36 -0.02 0.00 -0.22 0.00 0.00 54.13 52.74 3iuh s LEU 277 Cb 0.18 -2.40 0.04 0.00 0.50 0.00 0.00 46.19 44.50 3iuh s LEU 277 CO 0.02 -1.30 1.42 1.23 -1.32 0.00 0.00 176.35 176.39 3iuh h GLY 278 N 10.97 0.44 0.00 7.98 0.00 -0.96 -3.43 103.07 118.08 3iuh h GLY 278 Ca -0.15 -0.65 0.00 0.00 0.00 0.00 0.00 47.33 46.53 3iuh h GLY 278 CO 1.16 0.58 0.00 0.61 0.00 0.00 0.00 176.54 178.88 3iuh n GLY 279 N 0.61 0.08 3.23 4.60 0.00 -1.19 -0.16 105.19 112.36 3iuh n GLY 279 Ca -0.05 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.68 3iuh n GLY 279 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3iuh s PHE 280 N -2.00 2.39 -0.40 1.61 5.36 -1.25 -1.21 117.98 122.48 3iuh s PHE 280 Ca 0.00 -0.84 -0.14 0.00 -0.96 0.00 0.00 56.93 55.00 3iuh s PHE 280 Cb 0.00 -1.59 0.02 0.00 -0.34 0.00 0.00 43.02 41.11 3iuh s PHE 280 CO 0.00 -0.30 0.27 -1.01 -1.46 0.00 0.00 175.22 172.72 3iuh s HIS 281 N 0.10 3.24 0.22 10.12 3.76 0.12 -1.90 115.29 130.95 3iuh s HIS 281 Ca -0.11 -0.69 -0.27 0.00 -0.15 0.00 0.00 55.06 53.84 3iuh s HIS 281 Cb -0.15 -2.55 -0.09 0.00 1.11 0.00 0.00 32.58 30.90 3iuh s HIS 281 CO 0.06 -0.60 0.86 -0.06 -0.85 0.00 0.00 174.74 174.15 3iuh s PHE 282 N 1.64 3.91 0.00 1.40 0.08 0.88 -2.30 117.98 123.59 3iuh s PHE 282 Ca 0.04 1.76 0.00 0.00 0.12 0.00 0.00 56.93 58.85 3iuh s PHE 282 Cb -0.19 -2.87 0.00 0.00 -0.57 0.00 0.00 43.02 39.39 3iuh s PHE 282 CO 0.09 0.45 0.00 0.27 -0.10 0.00 0.00 175.22 175.93 3iuh n ASN 283 N 1.38 0.00 -4.40 1.36 2.04 -1.26 -1.59 115.26 112.79 3iuh n ASN 283 Ca -0.03 0.00 -0.20 0.00 -0.44 0.00 0.00 54.58 53.91 3iuh n ASN 283 Cb 0.48 0.00 -0.10 0.00 -2.53 0.00 0.00 39.78 37.63 3iuh n ASN 283 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 3iuh s ASP 284 N 0.00 1.97 0.03 0.53 -1.08 -0.12 -4.59 116.67 113.41 3iuh s ASP 284 Ca 0.00 -1.37 -0.28 0.00 -0.52 0.00 0.00 52.55 50.38 3iuh s ASP 284 Cb 0.00 -0.00 0.09 0.00 -1.46 0.00 0.00 42.92 41.55 3iuh s ASP 284 CO 0.00 -0.64 0.94 -0.94 0.52 0.00 0.00 175.17 175.05 3iuh s SER 285 N -3.42 -0.29 0.00 -0.34 1.04 -1.26 -1.82 113.70 107.61 3iuh s SER 285 Ca 0.37 -0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.67 3iuh s SER 285 Cb 0.08 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.59 3iuh s SER 285 CO 0.15 -0.67 0.00 1.17 0.98 0.00 0.00 173.24 174.87 3iuh n LYS 286 N -0.31 1.12 -0.04 4.02 4.81 -1.26 -4.75 118.16 121.76 3iuh n LYS 286 Ca -0.07 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.30 3iuh n LYS 286 Cb 0.61 -0.79 -0.02 0.00 0.02 0.00 0.00 35.03 34.85 3iuh n LYS 286 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3iuh n TYR 287 N -1.73 0.00 0.00 5.64 4.01 -1.26 -5.08 117.16 118.74 3iuh n TYR 287 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 3iuh n TYR 287 Cb 0.29 -0.32 0.00 0.00 -0.31 0.00 0.00 39.34 39.00 3iuh n TYR 287 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3iuh n GLY 288 N 2.31 5.10 3.12 2.72 0.00 -1.26 -4.91 105.19 112.27 3iuh n GLY 288 Ca -0.11 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.73 3iuh n GLY 288 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3iuh n ASP 289 N 0.00 5.36 0.26 1.61 2.03 -1.21 -4.75 116.55 119.85 3iuh n ASP 289 Ca 0.00 -3.11 0.14 0.00 0.52 0.00 0.00 54.79 52.34 3iuh n ASP 289 Cb 0.00 -1.47 0.63 0.00 -0.72 0.00 0.00 41.12 39.56 3iuh n ASP 289 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 3iuh h ASP 290 N 6.21 0.00 -4.29 1.67 3.32 -1.82 -3.47 116.42 118.04 3iuh h ASP 290 Ca 0.32 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 57.02 3iuh h ASP 290 Cb 0.72 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 3iuh h ASP 290 CO 1.41 0.12 -0.50 0.47 -1.72 0.00 0.00 179.24 179.01 3iuh n ASP 291 N -3.32 -4.90 -4.89 6.45 8.00 -1.24 -4.76 116.55 111.90 3iuh n ASP 291 Ca -0.00 -0.14 -0.29 0.00 0.71 0.00 0.00 54.79 55.07 3iuh n ASP 291 Cb 0.33 -4.05 0.08 0.00 -0.02 0.00 0.00 41.12 37.47 3iuh n ASP 291 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3iuh s LEU 292 N -6.24 2.60 0.15 0.64 1.43 -0.75 -0.77 118.68 115.74 3iuh s LEU 292 Ca 0.19 0.91 -0.34 0.00 -1.03 0.00 0.00 54.13 53.86 3iuh s LEU 292 Cb -0.09 -3.49 -0.15 0.00 0.03 0.00 0.00 46.19 42.49 3iuh s LEU 292 CO 0.24 -1.77 1.49 0.47 0.23 0.00 0.00 176.35 177.00 3iuh n ASP 293 N -3.25 2.67 -4.67 2.29 9.92 -1.26 -0.94 116.55 121.30 3iuh n ASP 293 Ca 0.08 1.10 -0.44 0.00 -0.53 0.00 0.00 54.79 54.99 3iuh n ASP 293 Cb 0.60 -1.37 -0.02 0.00 -0.64 0.00 0.00 41.12 39.69 3iuh n ASP 293 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3iuh n ALA 294 N 2.97 1.09 -0.77 2.24 0.00 -1.26 -1.87 120.51 122.91 3iuh n ALA 294 Ca 0.17 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.01 3iuh n ALA 294 Cb 0.27 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.45 3iuh n ALA 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iuh n GLY 295 N 1.92 0.70 0.23 0.00 0.00 -1.26 -4.77 105.19 102.00 3iuh n GLY 295 Ca 0.10 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.27 3iuh n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iuh h ALA 296 N 0.00 1.00 0.00 4.61 0.00 -1.74 -3.24 119.26 119.89 3iuh h ALA 296 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3iuh h ALA 296 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3iuh h ALA 296 CO 0.00 0.00 -1.49 -0.89 0.00 0.00 0.00 179.25 176.87 3iuh n ILE 297 N -2.92 0.48 -3.54 0.00 2.08 -1.26 -4.92 119.36 109.29 3iuh n ILE 297 Ca 0.02 -0.13 -0.27 0.00 0.56 0.00 0.00 62.75 62.93 3iuh n ILE 297 Cb 0.36 -1.49 -0.10 0.00 -0.75 0.00 0.00 39.64 37.66 3iuh n ILE 297 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3iuh n GLU 298 N -3.29 0.98 0.26 0.38 1.02 -1.26 -4.96 120.64 113.76 3iuh n GLU 298 Ca -0.17 -3.73 0.10 0.00 -0.02 0.00 0.00 57.16 53.34 3iuh n GLU 298 Cb 0.63 -1.87 0.70 0.00 -0.02 0.00 0.00 31.44 30.88 3iuh n GLU 298 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3iuh h PRO 299 N 5.24 0.00 -0.21 3.49 0.13 -1.91 -2.70 132.00 136.05 3iuh h PRO 299 Ca 0.20 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.23 3iuh h PRO 299 Cb 0.83 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.96 3iuh h PRO 299 CO 0.53 0.10 -0.27 -0.92 -0.23 0.00 0.00 178.00 177.21 3iuh h TYR 300 N 0.00 0.67 -0.90 1.56 3.20 -1.93 -2.17 116.97 117.40 3iuh h TYR 300 Ca -0.00 -0.22 0.09 0.00 3.14 0.00 0.00 58.73 61.74 3iuh h TYR 300 Cb 0.21 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.28 3iuh h TYR 300 CO 0.00 0.93 0.58 -0.09 -1.64 0.00 0.00 178.16 177.94 3iuh h ARG 301 N 0.23 0.89 -0.61 1.82 2.43 -1.91 0.18 114.38 117.40 3iuh h ARG 301 Ca 0.02 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 3iuh h ARG 301 Cb 0.84 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 3iuh h ARG 301 CO 0.06 0.59 0.21 1.25 -1.51 0.00 0.00 179.97 180.57 3iuh h LEU 302 N 0.92 0.88 -0.57 3.80 5.85 -1.29 -1.81 115.31 123.08 3iuh h LEU 302 Ca 0.41 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.88 3iuh h LEU 302 Cb 0.37 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 3iuh h LEU 302 CO -0.17 0.84 0.14 0.15 -0.34 0.00 0.00 178.44 179.06 3iuh h PHE 303 N 0.87 0.96 -0.27 1.25 3.57 -0.51 -2.38 116.94 120.43 3iuh h PHE 303 Ca 0.20 -0.11 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 3iuh h PHE 303 Cb 0.26 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 3iuh h PHE 303 CO 0.02 0.82 0.00 -0.07 -2.23 0.00 0.00 178.31 176.85 3iuh h LEU 304 N 0.82 0.37 -0.43 0.59 3.38 -0.34 0.20 115.31 119.90 3iuh h LEU 304 Ca 0.18 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 3iuh h LEU 304 Cb 0.35 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 3iuh h LEU 304 CO 0.00 0.43 -0.18 0.58 0.09 0.00 0.00 178.44 179.36 3iuh h VAL 305 N 0.39 1.28 0.00 1.22 2.07 -1.09 -2.64 116.25 117.48 3iuh h VAL 305 Ca 0.09 -1.32 -0.07 0.00 0.82 0.00 0.00 66.70 66.22 3iuh h VAL 305 Cb 0.26 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 3iuh h VAL 305 CO 0.01 0.45 -0.31 -0.26 0.02 0.00 0.00 177.57 177.47 3iuh h PHE 306 N 0.71 0.00 -0.76 1.57 0.04 -0.86 -2.47 116.94 115.17 3iuh h PHE 306 Ca 0.10 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.83 3iuh h PHE 306 Cb 0.74 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.86 3iuh h PHE 306 CO 0.05 0.31 0.33 -0.97 -0.60 0.00 0.00 178.31 177.43 3iuh h ASN 307 N 0.00 1.01 -0.01 2.17 -1.24 -0.28 0.10 115.58 117.33 3iuh h ASN 307 Ca -0.00 -0.14 -0.16 0.00 0.71 0.00 0.00 56.30 56.71 3iuh h ASN 307 Cb 0.78 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 39.57 3iuh h ASN 307 CO 0.04 0.88 -0.52 -0.33 -1.29 0.00 0.00 177.43 176.21 3iuh h GLU 308 N 1.09 0.58 -0.14 6.67 4.39 -1.26 -0.68 114.58 125.22 3iuh h GLU 308 Ca 0.26 -0.35 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 3iuh h GLU 308 Cb 0.16 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 3iuh h GLU 308 CO -0.03 0.96 0.03 -0.07 -1.16 0.00 0.00 179.01 178.74 3iuh h LEU 309 N 0.46 0.22 -1.09 1.33 3.38 -0.95 -2.07 115.31 116.58 3iuh h LEU 309 Ca 0.02 -0.24 -0.09 0.00 0.09 0.00 0.00 57.88 57.65 3iuh h LEU 309 Cb 1.06 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 3iuh h LEU 309 CO 0.10 0.40 -0.44 0.58 0.09 0.00 0.00 178.44 179.17 3iuh h VAL 310 N 0.02 1.32 -0.08 1.22 2.07 -0.78 -2.74 116.25 117.27 3iuh h VAL 310 Ca 0.04 -1.51 -0.12 0.00 0.82 0.00 0.00 66.70 65.93 3iuh h VAL 310 Cb 0.27 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.82 3iuh h VAL 310 CO 0.00 0.44 -0.49 -0.78 0.02 0.00 0.00 177.57 176.75 3iuh h ASP 311 N 0.04 0.23 -0.66 0.57 3.58 -0.98 -2.31 116.42 116.88 3iuh h ASP 311 Ca -0.00 -0.11 0.04 0.00 0.42 0.00 0.00 57.03 57.38 3iuh h ASP 311 Cb 0.79 -0.06 -0.04 0.00 1.72 0.00 0.00 39.33 41.73 3iuh h ASP 311 CO 0.06 0.69 0.43 0.00 -2.88 0.00 0.00 179.24 177.54 3iuh h ALA 312 N 1.32 1.67 0.01 -0.78 0.00 -1.06 0.15 119.26 120.57 3iuh h ALA 312 Ca 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3iuh h ALA 312 Cb 0.93 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3iuh h ALA 312 CO 0.07 0.26 -0.00 0.93 0.00 0.00 0.00 179.25 180.51 3iuh h GLU 313 N 0.75 -0.01 -0.27 0.00 5.08 -1.50 0.09 114.58 118.73 3iuh h GLU 313 Ca 0.27 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.71 3iuh h GLU 313 Cb 0.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3iuh h GLU 313 CO -0.08 0.64 0.20 0.00 -1.00 0.00 0.00 179.01 178.78 3iuh h ALA 314 N 0.31 2.22 -0.00 3.43 0.00 -0.93 0.78 119.26 125.07 3iuh h ALA 314 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3iuh h ALA 314 Cb 0.66 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3iuh h ALA 314 CO 0.00 -0.34 -0.06 0.54 0.00 0.00 0.00 179.25 179.39 3iuh n ARG 315 N -4.40 0.62 -2.13 0.00 1.74 0.47 -4.92 116.66 108.05 3iuh n ARG 315 Ca 0.03 -0.14 -0.10 0.00 -0.77 0.00 0.00 57.85 56.88 3iuh n ARG 315 Cb 0.36 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.29 3iuh n ARG 315 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3iuh n GLY 316 N 1.26 0.04 3.75 -0.13 0.00 0.27 -4.97 105.19 105.42 3iuh n GLY 316 Ca 0.15 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 3iuh n GLY 316 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iuh s VAL 317 N -2.47 2.15 0.04 1.61 1.01 0.00 -4.97 120.40 117.77 3iuh s VAL 317 Ca 0.00 0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.10 3iuh s VAL 317 Cb 0.00 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3iuh s VAL 317 CO 0.00 0.02 0.18 -0.54 0.00 0.00 0.00 175.10 174.76 3iuh s LYS 318 N -0.35 3.36 0.00 2.72 -0.14 -1.26 -4.35 119.74 119.73 3iuh s LYS 318 Ca 0.64 -0.43 0.00 0.00 -1.36 0.00 0.00 55.97 54.81 3iuh s LYS 318 Cb -0.47 -3.02 0.00 0.00 -1.68 0.00 0.00 37.83 32.66 3iuh s LYS 318 CO 0.46 0.63 0.00 0.41 -0.76 0.00 0.00 175.35 176.09 3iuh n GLY 319 N 0.55 0.50 3.56 -3.33 0.00 -1.26 -4.96 105.19 100.25 3iuh n GLY 319 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 3iuh n GLY 319 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3iuh s PHE 320 N -2.29 2.34 -0.39 1.61 5.36 -1.26 -4.87 117.98 118.48 3iuh s PHE 320 Ca 0.00 0.07 0.08 0.00 -0.96 0.00 0.00 56.93 56.12 3iuh s PHE 320 Cb 0.00 -4.60 0.26 0.00 -0.34 0.00 0.00 43.02 38.34 3iuh s PHE 320 CO 0.00 -1.97 0.55 0.72 -1.46 0.00 0.00 175.22 173.06 3iuh n HIS 321 N 9.22 -0.47 -1.84 10.12 8.25 -1.26 -5.09 115.22 134.15 3iuh n HIS 321 Ca 0.05 -3.49 -0.41 0.00 -0.26 0.00 0.00 57.72 53.61 3iuh n HIS 321 Cb 0.49 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.34 3iuh n HIS 321 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3iuh s PRO 322 N -1.18 4.00 -0.82 -0.41 0.04 -1.26 -4.96 135.00 130.41 3iuh s PRO 322 Ca 0.35 2.48 -0.18 0.00 0.04 0.00 0.00 61.00 63.69 3iuh s PRO 322 Cb 0.19 -2.88 0.14 0.00 0.04 0.00 0.00 34.50 31.98 3iuh s PRO 322 CO -0.11 -0.59 0.96 0.00 0.04 0.00 0.00 177.00 177.30 3iuh s ALA 323 N -1.15 3.49 0.28 8.56 0.00 0.78 -4.90 121.76 128.81 3iuh s ALA 323 Ca 0.55 -2.68 -0.28 0.00 0.00 0.00 0.00 51.96 49.55 3iuh s ALA 323 Cb -0.45 -3.83 -0.09 0.00 0.00 0.00 0.00 23.12 18.75 3iuh s ALA 323 CO 0.60 -2.71 0.95 -1.01 0.00 0.00 0.00 175.76 173.59 3iuh s HIS 324 N 2.35 3.84 0.00 0.00 3.76 -1.26 -3.84 115.29 120.14 3iuh s HIS 324 Ca 0.25 1.85 -0.13 0.00 -0.15 0.00 0.00 55.06 56.88 3iuh s HIS 324 Cb -0.11 -2.98 0.02 0.00 1.11 0.00 0.00 32.58 30.62 3iuh s HIS 324 CO -0.04 0.28 0.26 1.41 -0.85 0.00 0.00 174.74 175.80 3iuh s MET 325 N -1.54 0.65 -0.07 1.40 1.75 -0.80 -1.77 119.30 118.93 3iuh s MET 325 Ca 0.45 -0.33 -0.16 0.00 -1.25 0.00 0.00 55.69 54.40 3iuh s MET 325 Cb -0.24 0.28 -0.05 0.00 2.84 0.00 0.00 34.83 37.67 3iuh s MET 325 CO 0.30 -0.18 0.42 0.42 -0.65 0.00 0.00 175.02 175.32 3iuh s ILE 326 N -1.64 5.12 -0.33 10.11 1.01 -0.25 -0.09 121.20 135.14 3iuh s ILE 326 Ca -0.12 0.84 -0.02 0.00 0.00 0.00 0.00 60.65 61.35 3iuh s ILE 326 Cb -0.05 -3.74 0.11 0.00 0.01 0.00 0.00 42.46 38.80 3iuh s ILE 326 CO 0.02 0.46 0.16 -0.62 0.00 0.00 0.00 174.94 174.96 3iuh s ASP 327 N -0.24 3.51 0.17 3.58 -1.08 -0.62 -3.71 116.67 118.28 3iuh s ASP 327 Ca 0.23 -1.76 0.00 0.00 -0.52 0.00 0.00 52.55 50.51 3iuh s ASP 327 Cb -0.16 -0.55 -0.04 0.00 -1.46 0.00 0.00 42.92 40.71 3iuh s ASP 327 CO 0.11 -0.38 0.06 -1.10 0.52 0.00 0.00 175.17 174.38 3iuh s GLN 328 N 1.52 1.10 -0.09 4.34 -0.21 -1.26 -4.58 119.66 120.47 3iuh s GLN 328 Ca 0.13 -1.55 0.03 0.00 0.02 0.00 0.00 55.36 53.99 3iuh s GLN 328 Cb -0.19 0.03 0.01 0.00 1.00 0.00 0.00 33.01 33.85 3iuh s GLN 328 CO -0.20 -0.25 -0.17 0.45 -2.12 0.00 0.00 175.29 173.00 3iuh s SER 329 N -3.14 2.47 -0.56 5.90 0.15 0.05 -4.64 113.70 113.93 3iuh s SER 329 Ca 0.29 -0.44 -0.04 0.00 0.70 0.00 0.00 55.95 56.45 3iuh s SER 329 Cb 0.07 -1.13 0.15 0.00 -1.71 0.00 0.00 66.02 63.40 3iuh s SER 329 CO 0.06 0.07 0.39 -1.00 1.20 0.00 0.00 173.24 173.96 3iuh s HIS 330 N 0.66 3.48 -0.12 3.44 0.09 -1.26 -4.59 115.29 116.99 3iuh s HIS 330 Ca -0.13 -2.49 0.16 0.00 -0.00 0.00 0.00 55.06 52.59 3iuh s HIS 330 Cb -0.16 -3.28 -0.09 0.00 -0.00 0.00 0.00 32.58 29.04 3iuh s HIS 330 CO 0.04 -0.90 0.98 -0.91 -0.00 0.00 0.00 174.74 173.95 3iuh h ASN 331 N 7.52 0.00 0.00 1.40 2.35 -1.94 -1.47 115.58 123.43 3iuh h ASN 331 Ca -0.06 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.62 3iuh h ASN 331 Cb 1.00 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.22 3iuh h ASN 331 CO 0.73 0.58 -0.64 1.33 -1.65 0.00 0.00 177.43 177.78 3iuh n VAL 332 N -2.99 0.92 -4.07 2.81 0.24 -1.26 -4.73 118.33 109.27 3iuh n VAL 332 Ca -0.07 -1.67 -0.12 0.00 -2.04 0.00 0.00 64.34 60.44 3iuh n VAL 332 Cb 0.82 0.37 -0.06 0.00 -1.47 0.00 0.00 33.84 33.50 3iuh n VAL 332 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 3iuh s THR 333 N -1.37 0.00 -0.24 3.34 -4.23 -1.26 -5.10 115.64 106.78 3iuh s THR 333 Ca 0.29 -1.58 -0.29 0.00 -1.18 0.00 0.00 61.69 58.93 3iuh s THR 333 Cb 0.30 -2.41 -0.01 0.00 1.34 0.00 0.00 72.50 71.71 3iuh s THR 333 CO -0.08 0.00 1.42 -0.62 -0.54 0.00 0.00 174.62 174.80 3iuh s ASP 334 N -3.12 6.62 0.31 3.99 -1.08 -1.26 -4.89 116.67 117.24 3iuh s ASP 334 Ca 0.28 1.48 0.08 0.00 -0.52 0.00 0.00 52.55 53.88 3iuh s ASP 334 Cb 0.01 -2.54 0.88 0.00 -1.46 0.00 0.00 42.92 39.81 3iuh s ASP 334 CO 0.13 -1.08 1.70 -0.65 0.52 0.00 0.00 175.17 175.79 3iuh h PRO 335 N 9.61 0.43 -0.43 4.34 0.11 -1.86 -1.11 132.00 143.08 3iuh h PRO 335 Ca -0.29 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.76 3iuh h PRO 335 Cb 1.12 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 3iuh h PRO 335 CO 1.01 0.28 0.16 0.82 -0.21 0.00 0.00 178.00 180.06 3iuh h ILE 336 N 0.44 1.21 -0.48 4.15 2.04 -1.86 -1.41 117.51 121.60 3iuh h ILE 336 Ca 0.64 -0.67 -0.06 0.00 1.00 0.00 0.00 64.86 65.76 3iuh h ILE 336 Cb 1.28 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 3iuh h ILE 336 CO -0.54 0.24 0.04 -0.33 0.00 0.00 0.00 178.15 177.57 3iuh h GLU 337 N 0.56 0.81 -0.54 2.37 5.08 -1.63 -0.98 114.58 120.25 3iuh h GLU 337 Ca 0.14 -0.24 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 3iuh h GLU 337 Cb 0.22 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3iuh h GLU 337 CO -0.01 0.84 0.22 0.77 -1.00 0.00 0.00 179.01 179.83 3iuh h SER 338 N 0.67 0.74 -0.66 1.42 0.02 -1.28 -0.29 113.55 114.17 3iuh h SER 338 Ca 0.14 -0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 3iuh h SER 338 Cb 0.44 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 3iuh h SER 338 CO 0.02 0.70 0.28 -0.07 -1.14 0.00 0.00 176.83 176.61 3iuh h LEU 339 N 0.73 0.92 0.28 5.07 4.07 -1.14 0.93 115.31 126.18 3iuh h LEU 339 Ca 0.18 -0.13 -0.01 0.00 0.08 0.00 0.00 57.88 58.00 3iuh h LEU 339 Cb 0.18 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 41.69 3iuh h LEU 339 CO -0.02 0.82 -0.13 0.40 -1.08 0.00 0.00 178.44 178.43 3iuh h ILE 340 N 0.99 0.76 0.00 1.22 2.04 -0.58 -0.77 117.51 121.17 3iuh h ILE 340 Ca 0.23 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.78 3iuh h ILE 340 Cb 0.18 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 3iuh h ILE 340 CO -0.02 0.05 -0.35 0.78 0.00 0.00 0.00 178.15 178.61 3iuh h ASN 341 N -0.49 0.00 -0.13 1.72 4.21 -0.89 -1.57 115.58 118.42 3iuh h ASN 341 Ca -0.04 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.42 3iuh h ASN 341 Cb 0.37 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.57 3iuh h ASN 341 CO 0.06 0.35 -0.13 0.28 -1.29 0.00 0.00 177.43 176.70 3iuh h SER 342 N 0.00 0.34 -0.28 5.81 0.02 -0.69 0.28 113.55 119.03 3iuh h SER 342 Ca -0.00 -0.48 -0.02 0.00 -0.84 0.00 0.00 61.79 60.44 3iuh h SER 342 Cb 0.74 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 3iuh h SER 342 CO 0.05 0.75 0.11 0.00 -1.14 0.00 0.00 176.83 176.60 3iuh h ALA 343 N 0.60 1.55 -0.47 3.77 0.00 -1.02 -0.48 119.26 123.21 3iuh h ALA 343 Ca 0.02 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 3iuh h ALA 343 Cb 0.66 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3iuh h ALA 343 CO 0.03 0.34 -0.04 -0.91 0.00 0.00 0.00 179.25 178.68 3iuh h ASN 344 N 0.49 0.85 -0.67 0.00 -0.26 -1.03 -2.52 115.58 112.43 3iuh h ASN 344 Ca 0.12 -0.33 -0.06 0.00 -0.56 0.00 0.00 56.30 55.47 3iuh h ASN 344 Cb 0.15 -0.23 -0.03 0.00 -1.06 0.00 0.00 38.32 37.15 3iuh h ASN 344 CO -0.01 0.97 0.20 -0.33 -1.06 0.00 0.00 177.43 177.20 3iuh h GLU 345 N 0.71 1.07 -0.77 0.81 4.39 0.11 -0.20 114.58 120.70 3iuh h GLU 345 Ca 0.13 -0.23 -0.03 0.00 0.34 0.00 0.00 59.36 59.57 3iuh h GLU 345 Cb 0.56 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 29.02 3iuh h GLU 345 CO 0.03 0.93 0.37 0.82 -1.16 0.00 0.00 179.01 180.00 3iuh h ILE 346 N 1.03 1.25 -0.04 3.13 2.04 -1.03 -0.61 117.51 123.27 3iuh h ILE 346 Ca 0.22 -0.69 -0.12 0.00 1.00 0.00 0.00 64.86 65.27 3iuh h ILE 346 Cb 0.31 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 3iuh h ILE 346 CO -0.00 0.29 -0.52 0.03 0.00 0.00 0.00 178.15 177.95 3iuh h ARG 347 N 1.09 0.11 -0.16 2.37 3.08 -1.04 -2.15 114.38 117.67 3iuh h ARG 347 Ca 0.26 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 3iuh h ARG 347 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3iuh h ARG 347 CO -0.03 0.60 0.08 -0.09 -1.07 0.00 0.00 179.97 179.45 3iuh h ARG 348 N 0.09 0.23 -0.56 0.04 2.43 -0.20 -0.23 114.38 116.18 3iuh h ARG 348 Ca 0.00 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.08 3iuh h ARG 348 Cb 0.94 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.43 3iuh h ARG 348 CO 0.07 0.27 0.14 0.00 -1.51 0.00 0.00 179.97 178.95 3iuh h ALA 349 N 0.94 0.74 0.08 2.80 0.00 -1.04 -1.83 119.26 120.95 3iuh h ALA 349 Ca 0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 3iuh h ALA 349 Cb 0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3iuh h ALA 349 CO -0.01 0.44 -0.05 -0.92 0.00 0.00 0.00 179.25 178.71 3iuh h TYR 350 N 0.80 -0.12 -0.46 0.00 3.20 -1.25 -0.89 116.97 118.25 3iuh h TYR 350 Ca 0.18 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.10 3iuh h TYR 350 Cb 0.33 0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.60 3iuh h TYR 350 CO 0.02 -0.08 0.19 0.00 -1.64 0.00 0.00 178.16 176.66 3iuh h ALA 351 N 0.79 0.57 -0.88 1.82 0.00 -0.91 -0.26 119.26 120.40 3iuh h ALA 351 Ca -0.01 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3iuh h ALA 351 Cb 0.10 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3iuh h ALA 351 CO 0.01 -0.18 0.53 1.96 0.00 0.00 0.00 179.25 181.56 3iuh h GLN 352 N 0.39 1.19 -0.40 0.00 4.20 -1.17 -1.54 115.11 117.78 3iuh h GLN 352 Ca 0.21 -0.11 -0.07 0.00 0.06 0.00 0.00 58.65 58.75 3iuh h GLN 352 Cb 0.18 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 3iuh h GLN 352 CO -0.19 0.83 -0.03 0.00 -0.67 0.00 0.00 178.83 178.77 3iuh h ALA 353 N 1.37 1.20 0.00 3.87 0.00 -0.17 -1.62 119.26 123.91 3iuh h ALA 353 Ca 0.31 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3iuh h ALA 353 Cb -0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3iuh h ALA 353 CO -0.06 0.52 -0.08 -0.07 0.00 0.00 0.00 179.25 179.57 3iuh h LEU 354 N 0.61 0.00 0.00 0.00 3.38 -0.06 -2.62 115.31 116.63 3iuh h LEU 354 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3iuh h LEU 354 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3iuh h LEU 354 CO 0.02 0.08 -0.06 -0.07 0.09 0.00 0.00 178.44 178.50 3iuh h LEU 355 N 0.00 0.00 -9.53 1.67 3.38 -0.90 -3.46 115.31 106.46 3iuh h LEU 355 Ca -0.00 -0.02 -0.55 0.00 0.09 0.00 0.00 57.88 57.40 3iuh h LEU 355 Cb 0.32 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.12 3iuh h LEU 355 CO 0.01 0.01 0.97 0.52 0.09 0.00 0.00 178.44 180.04 3iuh n VAL 356 N -2.38 0.15 -2.48 1.22 0.31 -0.99 -4.82 118.33 109.33 3iuh n VAL 356 Ca 0.05 -0.03 -0.40 0.00 -0.01 0.00 0.00 64.34 63.96 3iuh n VAL 356 Cb 0.45 -1.86 -0.03 0.00 -0.91 0.00 0.00 33.84 31.49 3iuh n VAL 356 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3iuh s ASP 357 N 1.74 6.19 0.25 4.52 -1.08 -1.26 -4.85 116.67 122.18 3iuh s ASP 357 Ca 0.80 -0.95 -0.05 0.00 -0.52 0.00 0.00 52.55 51.83 3iuh s ASP 357 Cb -0.57 -2.56 0.34 0.00 -1.46 0.00 0.00 42.92 38.66 3iuh s ASP 357 CO 0.37 -1.78 1.88 0.03 0.52 0.00 0.00 175.17 176.19 3iuh h ARG 358 N 10.31 1.11 -0.18 4.34 2.47 -1.96 -0.20 114.38 130.28 3iuh h ARG 358 Ca 0.01 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 3iuh h ARG 358 Cb 1.03 -0.25 -0.01 0.00 -1.65 0.00 0.00 29.97 29.09 3iuh h ARG 358 CO 1.35 0.73 0.09 0.00 0.56 0.00 0.00 179.97 182.70 3iuh h ALA 359 N 1.41 0.23 -0.26 0.04 0.00 -1.99 0.15 119.26 118.84 3iuh h ALA 359 Ca 0.39 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 3iuh h ALA 359 Cb 0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3iuh h ALA 359 CO -0.15 -0.22 0.13 0.00 0.00 0.00 0.00 179.25 179.02 3iuh h ALA 360 N 0.96 0.33 -0.32 0.00 0.00 -1.88 -1.82 119.26 116.54 3iuh h ALA 360 Ca 0.06 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3iuh h ALA 360 Cb 0.11 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3iuh h ALA 360 CO -0.01 -0.12 0.11 1.25 0.00 0.00 0.00 179.25 180.49 3iuh h LEU 361 N 0.30 0.13 -0.94 0.00 5.85 -0.84 -1.59 115.31 118.21 3iuh h LEU 361 Ca 0.09 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.91 3iuh h LEU 361 Cb 0.09 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.08 3iuh h LEU 361 CO -0.01 0.11 0.60 -1.28 -0.34 0.00 0.00 178.44 177.51 3iuh h SER 362 N 0.25 0.95 -0.45 1.25 0.87 -0.47 -0.72 113.55 115.23 3iuh h SER 362 Ca 0.14 0.02 -0.11 0.00 -1.23 0.00 0.00 61.79 60.61 3iuh h SER 362 Cb 0.11 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 3iuh h SER 362 CO -0.14 0.60 -0.15 1.23 -0.53 0.00 0.00 176.83 177.84 3iuh h GLY 363 N 1.08 0.97 1.97 5.77 0.00 -0.81 -1.95 103.07 110.09 3iuh h GLY 363 Ca 0.41 -0.83 -0.08 0.00 0.00 0.00 0.00 47.33 46.83 3iuh h GLY 363 CO -0.18 0.75 -0.38 -0.97 0.00 0.00 0.00 176.54 175.76 3iuh h TYR 364 N 0.73 0.04 -0.05 5.60 0.05 -0.69 -1.94 116.97 120.71 3iuh h TYR 364 Ca 0.11 -0.01 -0.06 0.00 0.05 0.00 0.00 58.73 58.82 3iuh h TYR 364 Cb 0.70 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.44 3iuh h TYR 364 CO 0.05 0.41 -0.22 1.96 -1.05 0.00 0.00 178.16 179.32 3iuh h GLN 365 N 0.03 0.24 -0.70 4.88 4.20 -1.03 0.17 115.11 122.91 3iuh h GLN 365 Ca 0.00 -0.19 0.01 0.00 0.06 0.00 0.00 58.65 58.53 3iuh h GLN 365 Cb 0.69 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.47 3iuh h GLN 365 CO 0.05 0.83 0.46 0.93 -0.67 0.00 0.00 178.83 180.43 3iuh h GLU 366 N -0.30 0.92 -0.01 1.46 4.39 -1.25 -1.49 114.58 118.30 3iuh h GLU 366 Ca -0.01 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.63 3iuh h GLU 366 Cb 0.87 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 3iuh h GLU 366 CO 0.05 0.61 -0.05 -0.25 -1.16 0.00 0.00 179.01 178.20 3iuh n ASP 367 N -4.43 0.87 -3.36 1.42 8.00 -0.74 -4.93 116.55 113.38 3iuh n ASP 367 Ca 0.07 -1.11 -0.22 0.00 0.71 0.00 0.00 54.79 54.25 3iuh n ASP 367 Cb 0.04 -0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.21 3iuh n ASP 367 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3iuh n ASN 368 N -0.44 -5.79 -4.38 -2.24 4.13 -0.56 -4.92 115.26 101.06 3iuh n ASN 368 Ca 0.18 -0.50 -0.45 0.00 1.68 0.00 0.00 54.58 55.49 3iuh n ASN 368 Cb 0.28 -4.70 -0.00 0.00 -1.54 0.00 0.00 39.78 33.82 3iuh n ASN 368 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3iuh s ASP 369 N -3.36 7.24 0.18 6.41 -1.08 0.54 -4.87 116.67 121.73 3iuh s ASP 369 Ca 0.51 -3.39 -0.13 0.00 -0.52 0.00 0.00 52.55 49.01 3iuh s ASP 369 Cb -0.22 -2.27 0.16 0.00 -1.46 0.00 0.00 42.92 39.13 3iuh s ASP 369 CO 0.67 -0.44 1.74 0.00 0.52 0.00 0.00 175.17 177.67 3iuh h ALA 370 N 6.84 0.58 0.15 3.66 0.00 -1.91 -0.65 119.26 127.93 3iuh h ALA 370 Ca 0.22 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.20 3iuh h ALA 370 Cb 0.88 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 3iuh h ALA 370 CO 1.08 -0.23 -0.18 1.25 0.00 0.00 0.00 179.25 181.17 3iuh h LEU 371 N 0.33 -0.49 -1.35 0.00 5.85 -1.96 -0.37 115.31 117.33 3iuh h LEU 371 Ca 0.23 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.94 3iuh h LEU 371 Cb 0.25 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 3iuh h LEU 371 CO -0.24 -0.27 -0.29 0.24 -0.34 0.00 0.00 178.44 177.54 3iuh h MET 372 N -0.38 0.00 -0.18 1.25 2.86 -1.93 -0.36 114.93 116.20 3iuh h MET 372 Ca 0.01 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 3iuh h MET 372 Cb 0.37 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 3iuh h MET 372 CO -0.06 0.29 -0.02 0.00 1.06 0.00 0.00 176.91 178.17 3iuh h ALA 373 N 1.71 0.24 -0.33 6.32 0.00 -0.54 0.05 119.26 126.71 3iuh h ALA 373 Ca -0.00 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.53 3iuh h ALA 373 Cb 0.64 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3iuh h ALA 373 CO 0.04 -0.01 -0.39 0.00 0.00 0.00 0.00 179.25 178.88 3iuh h THR 374 N 0.06 1.28 0.00 0.00 1.03 -0.87 -2.60 112.91 111.81 3iuh h THR 374 Ca 0.05 -1.57 -0.03 0.00 -0.01 0.00 0.00 66.41 64.85 3iuh h THR 374 Cb 0.44 1.44 -0.00 0.00 -1.07 0.00 0.00 68.15 68.95 3iuh h THR 374 CO 0.01 0.51 -0.15 -0.08 -0.01 0.00 0.00 175.52 175.81 3iuh h GLU 375 N 0.66 0.00 -0.41 0.00 4.57 -0.95 -1.51 114.58 116.94 3iuh h GLU 375 Ca 0.05 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.14 3iuh h GLU 375 Cb 0.95 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.53 3iuh h GLU 375 CO 0.09 0.15 -0.13 1.15 -1.18 0.00 0.00 179.01 179.08 3iuh h THR 376 N 0.00 1.26 -0.19 0.32 2.02 -0.58 -1.08 112.91 114.65 3iuh h THR 376 Ca -0.00 -1.19 -0.10 0.00 0.77 0.00 0.00 66.41 65.89 3iuh h THR 376 Cb 0.27 1.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.76 3iuh h THR 376 CO 0.02 0.40 -0.27 -0.07 0.37 0.00 0.00 175.52 175.97 3iuh h LEU 377 N 0.67 0.57 -1.48 2.58 3.38 -1.21 -3.22 115.31 116.59 3iuh h LEU 377 Ca 0.11 -0.52 -0.00 0.00 0.09 0.00 0.00 57.88 57.56 3iuh h LEU 377 Cb 0.61 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3iuh h LEU 377 CO 0.04 0.97 0.29 0.11 0.09 0.00 0.00 178.44 179.95 3iuh h LYS 378 N 0.18 0.64 -0.25 1.13 1.79 -1.08 0.47 116.57 119.44 3iuh h LYS 378 Ca 0.02 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 3iuh h LYS 378 Cb 0.85 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.34 3iuh h LYS 378 CO 0.06 0.45 0.11 0.00 -1.08 0.00 0.00 179.45 179.00 3iuh h ARG 379 N 0.66 0.35 0.00 3.15 3.08 -1.21 0.69 114.38 121.10 3iuh h ARG 379 Ca 0.17 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 3iuh h ARG 379 Cb -0.03 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.94 3iuh h ARG 379 CO -0.03 0.28 -0.00 0.00 -1.07 0.00 0.00 179.97 179.15 3iuh h ALA 380 N 1.78 -0.00 -0.85 0.04 0.00 -1.36 -3.31 119.26 115.56 3iuh h ALA 380 Ca 0.09 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 3iuh h ALA 380 Cb 0.06 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3iuh h ALA 380 CO -0.01 -0.01 0.53 -0.92 0.00 0.00 0.00 179.25 178.83 3iuh h TYR 381 N -0.97 1.10 0.00 0.00 3.20 -0.48 -2.30 116.97 117.52 3iuh h TYR 381 Ca -0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3iuh h TYR 381 Cb 0.95 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.86 3iuh h TYR 381 CO 0.26 0.72 0.00 0.54 -1.64 0.00 0.00 178.16 178.04 3iuh n ARG 382 N -4.38 0.03 -2.38 1.82 1.74 0.24 -4.75 116.66 108.98 3iuh n ARG 382 Ca 0.09 0.25 -0.42 0.00 -0.77 0.00 0.00 57.85 57.00 3iuh n ARG 382 Cb 0.05 -1.55 -0.03 0.00 -1.02 0.00 0.00 32.46 29.91 3iuh n ARG 382 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3iuh s THR 383 N -3.04 4.06 -0.80 0.55 2.01 -0.87 -4.95 115.64 112.59 3iuh s THR 383 Ca 0.07 1.41 -0.25 0.00 0.31 0.00 0.00 61.69 63.23 3iuh s THR 383 Cb 0.10 -3.91 0.04 0.00 0.01 0.00 0.00 72.50 68.75 3iuh s THR 383 CO 0.31 0.01 1.28 -0.62 -0.69 0.00 0.00 174.62 174.91 3iuh s ASP 384 N 1.55 6.26 0.00 3.53 2.15 -1.26 -4.84 116.67 124.06 3iuh s ASP 384 Ca 0.59 -0.81 0.20 0.00 0.43 0.00 0.00 52.55 52.96 3iuh s ASP 384 Cb -0.27 -2.54 0.95 0.00 -0.30 0.00 0.00 42.92 40.76 3iuh s ASP 384 CO 0.24 -1.69 1.65 1.33 -0.17 0.00 0.00 175.17 176.53 3iuh n VAL 385 N 6.42 0.10 -0.31 1.11 0.24 -1.26 -4.38 118.33 120.25 3iuh n VAL 385 Ca 0.10 -0.18 0.14 0.00 -2.04 0.00 0.00 64.34 62.36 3iuh n VAL 385 Cb 0.49 0.06 0.31 0.00 -1.47 0.00 0.00 33.84 33.23 3iuh n VAL 385 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3iuh h GLU 386 N 1.17 0.41 -0.70 7.34 4.57 -1.97 0.66 114.58 126.06 3iuh h GLU 386 Ca 0.00 -0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.22 3iuh h GLU 386 Cb 0.26 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.71 3iuh h GLU 386 CO 0.00 0.27 0.46 -1.35 -1.18 0.00 0.00 179.01 177.21 3iuh h PRO 387 N 0.42 0.71 -0.24 0.92 0.11 -1.93 0.28 132.00 132.27 3iuh h PRO 387 Ca 0.57 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 66.54 3iuh h PRO 387 Cb 1.07 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 3iuh h PRO 387 CO -0.52 0.47 -0.22 0.82 -0.21 0.00 0.00 178.00 178.34 3iuh h ILE 388 N 0.73 1.31 -0.27 4.15 2.04 -1.22 -1.27 117.51 122.99 3iuh h ILE 388 Ca 0.30 -1.37 -0.00 0.00 1.00 0.00 0.00 64.86 64.79 3iuh h ILE 388 Cb 0.24 1.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 3iuh h ILE 388 CO -0.10 0.43 0.17 -0.07 0.00 0.00 0.00 178.15 178.58 3iuh h LEU 389 N 0.28 0.33 -0.25 1.44 4.07 -0.78 0.46 115.31 120.86 3iuh h LEU 389 Ca 0.04 -0.04 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 3iuh h LEU 389 Cb 0.77 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.41 3iuh h LEU 389 CO 0.06 0.27 0.07 0.00 -1.08 0.00 0.00 178.44 177.76 3iuh h ALA 390 N 1.07 0.33 -0.77 1.53 0.00 -0.99 -2.25 119.26 118.19 3iuh h ALA 390 Ca 0.10 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3iuh h ALA 390 Cb 0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3iuh h ALA 390 CO -0.02 -0.02 0.33 1.49 0.00 0.00 0.00 179.25 181.04 3iuh h GLU 391 N 0.24 1.12 -0.71 0.00 4.57 -1.11 0.58 114.58 119.27 3iuh h GLU 391 Ca 0.08 -0.18 -0.00 0.00 -1.18 0.00 0.00 59.36 58.08 3iuh h GLU 391 Cb 0.27 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.63 3iuh h GLU 391 CO 0.00 0.89 0.44 0.00 -1.18 0.00 0.00 179.01 179.16 3iuh h ALA 392 N 1.26 0.90 -0.06 2.92 0.00 -0.75 -0.30 119.26 123.23 3iuh h ALA 392 Ca 0.26 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3iuh h ALA 392 Cb 0.16 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3iuh h ALA 392 CO -0.03 0.36 0.00 0.00 0.00 0.00 0.00 179.25 179.58 3iuh h ARG 393 N 0.96 0.10 -0.61 0.00 3.08 -0.80 -2.70 114.38 114.40 3iuh h ARG 393 Ca 0.26 -0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.36 3iuh h ARG 393 Cb -0.06 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 29.92 3iuh h ARG 393 CO -0.05 0.36 0.27 -0.09 -1.07 0.00 0.00 179.97 179.40 3iuh h ARG 394 N -0.18 0.48 0.00 0.04 2.43 -0.54 0.55 114.38 117.15 3iuh h ARG 394 Ca 0.02 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3iuh h ARG 394 Cb 0.32 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3iuh h ARG 394 CO 0.00 0.32 0.00 0.00 -1.51 0.00 0.00 179.97 178.78 3iuh h ARG 395 N 0.49 0.00 -0.18 0.20 3.08 -1.02 -3.14 114.38 113.81 3iuh h ARG 395 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.35 3iuh h ARG 395 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3iuh h ARG 395 CO -0.26 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 178.89 3iuh n THR 396 N -2.39 1.81 -0.47 2.04 -2.24 -0.56 -4.96 114.28 107.51 3iuh n THR 396 Ca 0.02 -1.72 0.00 0.00 -2.27 0.00 0.00 64.05 60.08 3iuh n THR 396 Cb 0.24 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 3iuh n THR 396 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iuh n GLY 397 N -0.56 0.75 0.00 3.38 0.00 -0.98 -4.99 105.19 102.80 3iuh n GLY 397 Ca 0.16 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3iuh n GLY 397 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iuh n GLY 398 N -2.47 1.85 3.70 -0.02 0.00 0.18 -4.78 105.19 103.66 3iuh n GLY 398 Ca 0.00 -2.11 -0.35 0.00 0.00 0.00 0.00 46.02 43.56 3iuh n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iuh s ALA 399 N -2.05 3.41 0.22 4.61 0.00 -0.23 -4.21 121.76 123.52 3iuh s ALA 399 Ca 0.00 -0.76 -0.08 0.00 0.00 0.00 0.00 51.96 51.11 3iuh s ALA 399 Cb 0.00 -1.67 0.24 0.00 0.00 0.00 0.00 23.12 21.69 3iuh s ALA 399 CO 0.00 0.49 1.84 0.28 0.00 0.00 0.00 175.76 178.37 3iuh h VAL 400 N 4.33 1.04 -3.11 0.00 2.07 -1.86 -3.29 116.25 115.42 3iuh h VAL 400 Ca -0.48 -0.29 -0.62 0.00 0.82 0.00 0.00 66.70 66.14 3iuh h VAL 400 Cb 1.19 0.13 -0.40 0.00 -1.52 0.00 0.00 31.29 30.69 3iuh h VAL 400 CO 0.59 0.15 -0.71 -0.62 0.02 0.00 0.00 177.57 177.01 3iuh s ASP 401 N -5.71 3.86 0.16 0.57 -1.08 -1.26 -4.65 116.67 108.55 3iuh s ASP 401 Ca -0.13 -2.71 -0.26 0.00 -0.52 0.00 0.00 52.55 48.93 3iuh s ASP 401 Cb 0.16 -1.21 0.01 0.00 -1.46 0.00 0.00 42.92 40.42 3iuh s ASP 401 CO 0.77 -0.26 1.58 -0.65 0.52 0.00 0.00 175.17 177.13 3iuh h PRO 402 N 6.70 -0.30 -0.72 4.34 0.11 -1.86 -0.88 132.00 139.38 3iuh h PRO 402 Ca -0.03 0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.04 3iuh h PRO 402 Cb 0.92 0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 3iuh h PRO 402 CO 0.54 -0.20 0.23 0.28 -0.21 0.00 0.00 178.00 178.64 3iuh h VAL 403 N -0.32 1.26 -0.65 3.15 2.07 -1.95 0.16 116.25 119.97 3iuh h VAL 403 Ca 0.14 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 3iuh h VAL 403 Cb 0.58 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 3iuh h VAL 403 CO -0.57 0.35 0.36 0.00 0.02 0.00 0.00 177.57 177.73 3iuh h ALA 404 N 1.11 0.84 -0.48 1.67 0.00 -1.91 0.11 119.26 120.59 3iuh h ALA 404 Ca 0.23 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 3iuh h ALA 404 Cb 0.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3iuh h ALA 404 CO -0.01 0.35 -0.21 1.15 0.00 0.00 0.00 179.25 180.54 3iuh h THR 405 N 0.89 1.27 -0.63 0.00 2.02 -0.91 -0.65 112.91 114.90 3iuh h THR 405 Ca 0.23 -1.37 0.02 0.00 0.77 0.00 0.00 66.41 66.06 3iuh h THR 405 Cb 0.04 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 3iuh h THR 405 CO -0.04 0.47 0.41 0.22 0.37 0.00 0.00 175.52 176.95 3iuh h TYR 406 N 0.85 0.77 -0.31 3.16 3.20 -0.18 -2.03 116.97 122.43 3iuh h TYR 406 Ca 0.11 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 61.82 3iuh h TYR 406 Cb 0.78 -0.26 -0.00 0.00 1.54 0.00 0.00 36.73 38.79 3iuh h TYR 406 CO 0.05 0.47 -0.50 0.00 -1.64 0.00 0.00 178.16 176.53 3iuh h ARG 407 N 0.82 0.88 0.00 1.82 3.08 -0.82 -3.05 114.38 117.12 3iuh h ARG 407 Ca 0.24 -0.54 -0.01 0.00 0.07 0.00 0.00 59.98 59.75 3iuh h ARG 407 Cb -0.05 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 3iuh h ARG 407 CO -0.07 1.18 -0.03 0.00 -1.07 0.00 0.00 179.97 179.98 3iuh h ALA 408 N 0.70 1.08 0.00 0.04 0.00 -0.85 -2.10 119.26 118.12 3iuh h ALA 408 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3iuh h ALA 408 Cb 1.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3iuh h ALA 408 CO 0.11 0.03 -0.34 0.66 0.00 0.00 0.00 179.25 179.71 3iuh h SER 409 N 0.00 0.00 -0.87 0.00 4.64 -1.26 -3.48 113.55 112.59 3iuh h SER 409 Ca -0.00 -0.04 -0.25 0.00 -0.47 0.00 0.00 61.79 61.03 3iuh h SER 409 Cb 0.23 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.24 3iuh h SER 409 CO 0.00 0.02 -0.25 0.61 -0.87 0.00 0.00 176.83 176.34 3iuh n GLY 410 N 1.20 0.99 0.27 -0.77 0.00 -0.79 -4.91 105.19 101.19 3iuh n GLY 410 Ca 0.03 -0.43 0.03 0.00 0.00 0.00 0.00 46.02 45.66 3iuh n GLY 410 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3iuh h TYR 411 N 0.00 0.59 -0.44 1.61 5.03 -1.84 -1.67 116.97 120.25 3iuh h TYR 411 Ca -0.26 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.07 3iuh h TYR 411 Cb 0.91 -0.15 -0.02 0.00 1.55 0.00 0.00 36.73 39.01 3iuh h TYR 411 CO 0.35 0.15 0.26 -0.09 -1.32 0.00 0.00 178.16 177.51 3iuh h ARG 412 N 0.53 0.61 -0.59 1.82 9.65 -1.91 -1.73 114.38 122.76 3iuh h ARG 412 Ca 0.39 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 59.20 3iuh h ARG 412 Cb 0.50 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.93 3iuh h ARG 412 CO -0.33 0.46 0.33 0.00 2.80 0.00 0.00 179.97 183.22 3iuh h ALA 413 N 1.12 1.46 0.19 2.80 0.00 -1.81 -0.38 119.26 122.64 3iuh h ALA 413 Ca 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3iuh h ALA 413 Cb 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3iuh h ALA 413 CO -0.03 0.45 -0.09 -0.09 0.00 0.00 0.00 179.25 179.49 3iuh h ARG 414 N 0.82 -0.25 0.00 0.00 2.43 -0.71 -2.40 114.38 114.27 3iuh h ARG 414 Ca 0.21 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.36 3iuh h ARG 414 Cb 0.02 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 3iuh h ARG 414 CO -0.04 -0.01 -0.17 -0.39 -1.51 0.00 0.00 179.97 177.85 3iuh h VAL 415 N -0.46 0.47 -0.68 0.20 -1.51 -1.19 -2.26 116.25 110.82 3iuh h VAL 415 Ca -0.03 -0.91 -0.06 0.00 -1.23 0.00 0.00 66.70 64.48 3iuh h VAL 415 Cb 0.35 1.64 -0.03 0.00 -2.13 0.00 0.00 31.29 31.12 3iuh h VAL 415 CO 0.04 0.17 0.20 0.00 -1.23 0.00 0.00 177.57 176.75 3iuh h ALA 416 N 1.83 1.07 -0.04 5.19 0.00 -0.84 0.01 119.26 126.48 3iuh h ALA 416 Ca -0.00 -0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.50 3iuh h ALA 416 Cb 0.63 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3iuh h ALA 416 CO 0.02 0.63 -0.77 0.00 0.00 0.00 0.00 179.25 179.13 3iuh h ALA 417 N 1.21 0.59 0.00 0.00 0.00 -0.91 -3.18 119.26 116.97 3iuh h ALA 417 Ca 0.22 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3iuh h ALA 417 Cb 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3iuh h ALA 417 CO -0.01 0.80 -0.11 0.39 0.00 0.00 0.00 179.25 180.33 3iuh n GLU 418 N -3.78 0.13 -4.30 0.00 1.02 -0.92 -4.85 120.64 107.93 3iuh n GLU 418 Ca -0.04 0.09 -0.25 0.00 -0.02 0.00 0.00 57.16 56.95 3iuh n GLU 418 Cb 0.73 -1.64 -0.13 0.00 -0.02 0.00 0.00 31.44 30.39 3iuh n GLU 418 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3iuh s ARG 419 N -3.06 1.17 0.00 3.49 0.52 -0.04 -5.07 118.95 115.97 3iuh s ARG 419 Ca 0.12 -1.20 0.00 0.00 -0.52 0.00 0.00 55.73 54.13 3iuh s ARG 419 Cb 0.16 -1.47 0.01 0.00 0.52 0.00 0.00 34.95 34.16 3iuh s ARG 419 CO 0.59 0.34 0.51 -0.35 0.02 0.00 0.00 175.30 176.41