#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 0.95 -5.45 -4.13 2.47 -1.93 -3.40 114.38 102.90 3iuh h ARG 5 Ca 0.00 -0.06 -0.64 0.00 -1.26 0.00 0.00 59.98 58.03 3iuh h ARG 5 Cb 0.00 -0.21 -0.16 0.00 -1.65 0.00 0.00 29.97 27.94 3iuh h ARG 5 CO 0.00 0.63 -0.59 0.42 0.56 0.00 0.00 179.97 180.99 3iuh s ILE 6 N -6.12 4.54 0.25 2.04 -1.09 -1.26 -5.02 121.20 114.55 3iuh s ILE 6 Ca -0.13 -0.13 -0.31 0.00 -2.23 0.00 0.00 60.65 57.85 3iuh s ILE 6 Cb 0.16 -3.00 -0.12 0.00 -1.58 0.00 0.00 42.46 37.92 3iuh s ILE 6 CO 0.78 0.51 1.67 0.00 -1.23 0.00 0.00 174.94 176.67 3iuh s ALA 7 N 0.01 3.85 0.34 9.38 0.00 -1.26 -4.90 121.76 129.18 3iuh s ALA 7 Ca 0.04 1.60 0.03 0.00 0.00 0.00 0.00 51.96 53.63 3iuh s ALA 7 Cb -0.12 -3.68 0.63 0.00 0.00 0.00 0.00 23.12 19.95 3iuh s ALA 7 CO 0.01 -0.97 1.96 1.96 0.00 0.00 0.00 175.76 178.73 3iuh h GLN 8 N 5.81 0.86 -0.14 0.00 4.20 -1.97 -1.58 115.11 122.29 3iuh h GLN 8 Ca -0.45 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.16 3iuh h GLN 8 Cb 1.21 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.78 3iuh h GLN 8 CO 0.88 0.57 -0.12 0.38 -0.67 0.00 0.00 178.83 179.87 3iuh h ASP 9 N 0.89 0.21 -0.13 1.46 3.04 -1.98 0.30 116.42 120.20 3iuh h ASP 9 Ca 0.31 -0.04 -0.09 0.00 -3.24 0.00 0.00 57.03 53.97 3iuh h ASP 9 Cb 0.12 -0.05 0.00 0.00 -1.04 0.00 0.00 39.33 38.35 3iuh h ASP 9 CO -0.10 0.36 -0.28 0.58 -2.04 0.00 0.00 179.24 177.76 3iuh h VAL 10 N 0.21 1.37 -0.43 4.15 2.07 -1.68 0.95 116.25 122.89 3iuh h VAL 10 Ca 0.04 -1.55 -0.01 0.00 0.82 0.00 0.00 66.70 66.00 3iuh h VAL 10 Cb 0.35 2.04 -0.02 0.00 -1.52 0.00 0.00 31.29 32.13 3iuh h VAL 10 CO 0.02 0.46 0.21 0.58 0.02 0.00 0.00 177.57 178.86 3iuh h VAL 11 N 0.03 1.18 -0.07 2.57 2.07 -0.99 0.46 116.25 121.49 3iuh h VAL 11 Ca 0.00 -0.49 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 3iuh h VAL 11 Cb 0.88 0.72 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 3iuh h VAL 11 CO 0.06 0.19 0.03 0.00 0.02 0.00 0.00 177.57 177.87 3iuh h ALA 12 N 1.06 0.10 -0.17 1.67 0.00 -0.39 -0.75 119.26 120.78 3iuh h ALA 12 Ca 0.15 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3iuh h ALA 12 Cb 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3iuh h ALA 12 CO -0.02 -0.33 0.08 -0.09 0.00 0.00 0.00 179.25 178.89 3iuh h ARG 13 N -0.02 0.17 0.00 0.00 2.43 -0.64 -0.66 114.38 115.66 3iuh h ARG 13 Ca 0.02 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 3iuh h ARG 13 Cb 0.14 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 3iuh h ARG 13 CO -0.00 0.11 -0.24 0.93 -1.51 0.00 0.00 179.97 179.26 3iuh h GLU 14 N 0.17 0.00 -0.04 0.20 4.39 -0.84 -1.72 114.58 116.75 3iuh h GLU 14 Ca 0.07 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.70 3iuh h GLU 14 Cb 0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 3iuh h GLU 14 CO -0.05 0.24 -0.23 -0.91 -1.16 0.00 0.00 179.01 176.90 3iuh h ASN 15 N 0.00 0.27 -0.78 1.42 -0.26 -0.66 -3.22 115.58 112.35 3iuh h ASN 15 Ca -0.00 -0.68 0.05 0.00 -0.56 0.00 0.00 56.30 55.11 3iuh h ASN 15 Cb 0.55 -0.08 -0.05 0.00 -1.06 0.00 0.00 38.32 37.68 3iuh h ASN 15 CO 0.03 0.91 0.51 0.44 -1.06 0.00 0.00 177.43 178.26 3iuh h ASP 16 N -0.35 0.78 0.08 5.81 3.32 -0.88 0.17 116.42 125.34 3iuh h ASP 16 Ca -0.02 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 3iuh h ASP 16 Cb 0.91 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 3iuh h ASP 16 CO 0.05 0.52 -0.06 -0.09 -1.72 0.00 0.00 179.24 177.93 3iuh h ARG 17 N 0.89 0.00 -0.01 3.56 2.43 -1.34 -2.82 114.38 117.09 3iuh h ARG 17 Ca 0.32 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 3iuh h ARG 17 Cb 0.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3iuh h ARG 17 CO -0.10 0.06 -0.18 0.54 -1.51 0.00 0.00 179.97 178.78 3iuh n ARG 18 N -4.31 1.64 -0.15 0.20 1.74 -0.49 -4.69 116.66 110.59 3iuh n ARG 18 Ca -0.03 -0.82 -0.03 0.00 -0.77 0.00 0.00 57.85 56.20 3iuh n ARG 18 Cb 0.15 -1.17 0.04 0.00 -1.02 0.00 0.00 32.46 30.46 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 2.17 0.35 0.27 7.54 0.00 -0.45 -2.21 119.26 126.93 3iuh h ALA 19 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3iuh h ALA 19 Cb 0.43 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3iuh h ALA 19 CO 0.00 -0.43 -0.29 1.03 0.00 0.00 0.00 179.25 179.56 3iuh h SER 20 N 0.02 -0.78 -0.77 0.00 0.87 -1.84 -1.55 113.55 109.49 3iuh h SER 20 Ca 0.24 0.07 0.04 0.00 -1.23 0.00 0.00 61.79 60.91 3iuh h SER 20 Cb 0.36 0.27 -0.05 0.00 -0.44 0.00 0.00 62.40 62.54 3iuh h SER 20 CO -0.49 -0.41 0.48 0.00 -0.53 0.00 0.00 176.83 175.88 3iuh h ALA 21 N -0.00 1.02 -0.21 6.23 0.00 -1.86 -2.45 119.26 121.99 3iuh h ALA 21 Ca -0.01 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3iuh h ALA 21 Cb 0.56 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 3iuh h ALA 21 CO -0.07 0.27 0.02 1.25 0.00 0.00 0.00 179.25 180.72 3iuh h LEU 22 N 0.93 -0.04 -0.44 0.00 5.85 -1.16 -1.08 115.31 119.37 3iuh h LEU 22 Ca 0.32 0.04 0.07 0.00 0.84 0.00 0.00 57.88 59.15 3iuh h LEU 22 Cb 0.05 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.08 3iuh h LEU 22 CO -0.13 0.01 0.07 0.50 -0.34 0.00 0.00 178.44 178.56 3iuh h LYS 23 N 0.09 0.19 0.17 1.25 3.64 -0.93 0.33 116.57 121.32 3iuh h LYS 23 Ca 0.09 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 3iuh h LYS 23 Cb 0.11 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 3iuh h LYS 23 CO -0.14 0.13 -0.29 0.93 -2.27 0.00 0.00 179.45 177.80 3iuh h GLU 24 N 0.20 -0.52 -0.59 1.90 4.39 -0.96 -0.55 114.58 118.45 3iuh h GLU 24 Ca 0.22 0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.90 3iuh h GLU 24 Cb 0.28 0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 3iuh h GLU 24 CO -0.30 -0.35 0.15 -0.44 -1.16 0.00 0.00 179.01 176.92 3iuh h ASP 25 N -0.54 0.88 -0.34 1.42 3.32 -0.81 -0.89 116.42 119.46 3iuh h ASP 25 Ca 0.02 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 56.83 3iuh h ASP 25 Cb 0.54 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 3iuh h ASP 25 CO -0.14 0.88 0.19 0.22 -1.72 0.00 0.00 179.24 178.67 3iuh h TYR 26 N 0.84 0.47 -0.49 4.55 3.20 -0.21 0.75 116.97 126.08 3iuh h TYR 26 Ca 0.19 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.95 3iuh h TYR 26 Cb 0.34 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 3iuh h TYR 26 CO 0.02 0.37 -0.07 0.93 -1.64 0.00 0.00 178.16 177.77 3iuh h GLU 27 N 0.43 0.86 -0.31 1.82 5.08 -1.00 0.21 114.58 121.68 3iuh h GLU 27 Ca 0.12 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 3iuh h GLU 27 Cb 0.06 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3iuh h GLU 27 CO -0.02 0.91 0.14 0.00 -1.00 0.00 0.00 179.01 179.03 3iuh h ALA 28 N 1.13 0.40 -0.41 3.43 0.00 -0.80 -1.55 119.26 121.46 3iuh h ALA 28 Ca 0.14 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 3iuh h ALA 28 Cb 0.57 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3iuh h ALA 28 CO 0.03 -0.03 -0.03 1.25 0.00 0.00 0.00 179.25 180.47 3iuh h LEU 29 N 0.35 0.73 -1.55 0.00 5.85 -0.58 -1.53 115.31 118.59 3iuh h LEU 29 Ca 0.10 -0.33 0.03 0.00 0.84 0.00 0.00 57.88 58.52 3iuh h LEU 29 Cb 0.14 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 3iuh h LEU 29 CO -0.01 0.88 0.34 1.23 -0.34 0.00 0.00 178.44 180.54 3iuh h GLY 30 N 0.56 0.66 0.56 3.75 0.00 -0.45 0.20 103.07 108.35 3iuh h GLY 30 Ca 0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.20 3iuh h GLY 30 CO 0.03 0.21 -0.06 0.00 0.00 0.00 0.00 176.54 176.72 3iuh h ALA 31 N 1.70 -0.16 -0.85 3.60 0.00 -0.99 0.57 119.26 123.14 3iuh h ALA 31 Ca 0.20 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.96 3iuh h ALA 31 Cb 0.07 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 3iuh h ALA 31 CO -0.05 -0.37 0.53 -0.97 0.00 0.00 0.00 179.25 178.39 3iuh h ASN 32 N -0.60 0.84 -0.28 0.00 -0.73 -0.85 -0.62 115.58 113.34 3iuh h ASN 32 Ca -0.02 0.01 -0.08 0.00 1.87 0.00 0.00 56.30 58.08 3iuh h ASN 32 Cb 0.47 -0.16 -0.02 0.00 0.27 0.00 0.00 38.32 38.88 3iuh h ASN 32 CO 0.03 0.55 -0.09 -0.07 -0.37 0.00 0.00 177.43 177.47 3iuh h LEU 33 N 0.98 0.66 -0.70 0.34 3.38 -0.56 -2.55 115.31 116.87 3iuh h LEU 33 Ca 0.36 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 3iuh h LEU 33 Cb 0.14 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3iuh h LEU 33 CO -0.16 0.79 0.36 0.00 0.09 0.00 0.00 178.44 179.52 3iuh h ALA 34 N 1.28 0.90 0.00 1.53 0.00 0.58 0.17 119.26 123.70 3iuh h ALA 34 Ca 0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3iuh h ALA 34 Cb 0.53 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3iuh h ALA 34 CO 0.03 0.44 -0.01 0.00 0.00 0.00 0.00 179.25 179.71 3iuh h ARG 35 N 0.97 0.00 -0.27 0.00 3.08 -0.85 -0.69 114.38 116.62 3iuh h ARG 35 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 3iuh h ARG 35 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 3iuh h ARG 35 CO -0.03 0.01 0.00 0.54 -1.07 0.00 0.00 179.97 179.41 3iuh n ARG 36 N -3.12 2.13 -1.30 0.04 1.74 -0.27 -4.92 116.66 110.96 3iuh n ARG 36 Ca -0.01 -1.70 -0.03 0.00 -0.77 0.00 0.00 57.85 55.34 3iuh n ARG 36 Cb 0.19 -1.45 -0.01 0.00 -1.02 0.00 0.00 32.46 30.16 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 1.32 0.50 3.24 -0.13 0.00 -0.27 -5.03 105.19 104.82 3iuh n GLY 37 Ca 0.18 -0.92 -0.32 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.10 2.06 -0.48 1.61 1.01 0.42 -5.00 120.40 117.92 3iuh s VAL 38 Ca 0.00 -1.03 -0.20 0.00 0.00 0.00 0.00 61.98 60.75 3iuh s VAL 38 Cb 0.00 -1.77 0.04 0.00 0.00 0.00 0.00 36.38 34.65 3iuh s VAL 38 CO 0.00 0.56 0.64 -0.62 0.00 0.00 0.00 175.10 175.69 3iuh s ASP 39 N 0.18 6.27 0.39 3.32 2.15 -1.26 -2.92 116.67 124.79 3iuh s ASP 39 Ca -0.14 -0.63 0.18 0.00 0.43 0.00 0.00 52.55 52.39 3iuh s ASP 39 Cb -0.17 -2.31 1.10 0.00 -0.30 0.00 0.00 42.92 41.24 3iuh s ASP 39 CO 0.07 -0.85 1.74 -0.29 -0.17 0.00 0.00 175.17 175.67 3iuh h ILE 40 N 5.87 0.47 -0.23 4.11 2.10 -1.91 0.49 117.51 128.41 3iuh h ILE 40 Ca -0.26 -0.13 -0.02 0.00 1.08 0.00 0.00 64.86 65.52 3iuh h ILE 40 Cb 1.09 0.05 -0.01 0.00 -1.09 0.00 0.00 36.82 36.86 3iuh h ILE 40 CO 0.93 0.07 0.03 -0.33 -1.08 0.00 0.00 178.15 177.78 3iuh h GLU 41 N 0.39 0.33 -0.21 2.19 4.39 -1.97 -0.94 114.58 118.76 3iuh h GLU 41 Ca 0.63 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 60.19 3iuh h GLU 41 Cb 1.57 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 30.15 3iuh h GLU 41 CO -0.36 0.33 -0.28 0.00 -1.16 0.00 0.00 179.01 177.55 3iuh h ALA 42 N 1.71 1.13 0.20 3.43 0.00 -1.31 -1.23 119.26 123.19 3iuh h ALA 42 Ca 0.08 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3iuh h ALA 42 Cb 0.17 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3iuh h ALA 42 CO 0.00 0.55 -0.10 0.28 0.00 0.00 0.00 179.25 179.98 3iuh h VAL 43 N 0.36 0.61 -1.00 0.00 2.07 -1.32 -3.12 116.25 113.85 3iuh h VAL 43 Ca 0.05 -1.04 0.16 0.00 0.82 0.00 0.00 66.70 66.69 3iuh h VAL 43 Cb 0.68 1.04 -0.10 0.00 -1.52 0.00 0.00 31.29 31.40 3iuh h VAL 43 CO 0.05 0.16 0.62 0.74 0.02 0.00 0.00 177.57 179.17 3iuh h THR 44 N -0.94 0.80 -0.91 2.57 2.02 -1.21 0.11 112.91 115.35 3iuh h THR 44 Ca -0.03 -0.30 0.04 0.00 0.77 0.00 0.00 66.41 66.89 3iuh h THR 44 Cb 0.47 -0.14 -0.05 0.00 -1.74 0.00 0.00 68.15 66.69 3iuh h THR 44 CO 0.05 0.16 0.59 0.00 0.37 0.00 0.00 175.52 176.68 3iuh h ALA 45 N 1.60 1.21 0.10 6.16 0.00 -1.29 -1.01 119.26 126.03 3iuh h ALA 45 Ca 0.54 -0.04 -0.26 0.00 0.00 0.00 0.00 54.91 55.15 3iuh h ALA 45 Cb 0.72 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.20 3iuh h ALA 45 CO -0.33 0.45 -1.17 0.87 0.00 0.00 0.00 179.25 179.08 3iuh h LYS 46 N 1.15 0.31 -0.69 0.00 1.57 -1.01 -3.31 116.57 114.58 3iuh h LYS 46 Ca 0.36 -0.47 -0.03 0.00 -1.87 0.00 0.00 60.65 58.65 3iuh h LYS 46 Cb 0.01 0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 3iuh h LYS 46 CO -0.12 1.19 0.33 0.28 -0.57 0.00 0.00 179.45 180.56 3iuh h VAL 47 N 0.12 1.23 0.00 0.50 2.07 -0.47 -1.89 116.25 117.80 3iuh h VAL 47 Ca -0.12 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.75 3iuh h VAL 47 Cb 1.87 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 3iuh h VAL 47 CO 0.19 0.27 0.00 -1.84 0.02 0.00 0.00 177.57 176.21 3iuh n GLU 48 N -4.45 0.00 -0.13 1.57 0.28 -0.42 -1.99 120.64 115.51 3iuh n GLU 48 Ca 0.05 0.29 0.07 0.00 -0.16 0.00 0.00 57.16 57.42 3iuh n GLU 48 Cb 0.13 -1.50 0.14 0.00 1.43 0.00 0.00 31.44 31.64 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 -1.51 2.02 -3.15 3.44 4.76 -0.74 -4.93 118.16 118.06 3iuh n LYS 49 Ca 0.03 -1.84 -0.41 0.00 -2.87 0.00 0.00 58.31 53.22 3iuh n LYS 49 Cb 0.14 -1.32 -0.07 0.00 -1.84 0.00 0.00 35.03 31.94 3iuh n LYS 49 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 3iuh s PHE 50 N -1.10 3.21 0.20 2.13 5.36 -0.84 -5.05 117.98 121.89 3iuh s PHE 50 Ca 0.24 0.51 0.11 0.00 -0.96 0.00 0.00 56.93 56.84 3iuh s PHE 50 Cb 0.14 -2.96 -0.04 0.00 -0.34 0.00 0.00 43.02 39.82 3iuh s PHE 50 CO 0.20 -0.47 -0.21 -0.06 -1.46 0.00 0.00 175.22 173.21 3iuh s PHE 51 N 2.55 2.35 -0.03 10.12 0.08 -1.26 -4.70 117.98 127.09 3iuh s PHE 51 Ca 0.24 -0.34 -0.01 0.00 0.12 0.00 0.00 56.93 56.94 3iuh s PHE 51 Cb -0.15 -1.15 0.03 0.00 -0.57 0.00 0.00 43.02 41.18 3iuh s PHE 51 CO 0.12 0.52 0.05 0.54 -0.10 0.00 0.00 175.22 176.35 3iuh s VAL 52 N -1.75 -0.05 0.52 -0.44 0.11 0.24 -4.85 120.40 114.18 3iuh s VAL 52 Ca 0.22 0.17 -0.22 0.00 -2.93 0.00 0.00 61.98 59.23 3iuh s VAL 52 Cb -0.08 -0.10 -0.06 0.00 -1.53 0.00 0.00 36.38 34.61 3iuh s VAL 52 CO 0.11 0.07 1.24 0.00 -3.33 0.00 0.00 175.10 173.19 3iuh s ALA 53 N 0.90 2.83 -0.11 1.54 0.00 -0.81 -4.23 121.76 121.87 3iuh s ALA 53 Ca -0.07 1.09 -0.03 0.00 0.00 0.00 0.00 51.96 52.94 3iuh s ALA 53 Cb -0.10 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.52 3iuh s ALA 53 CO -0.03 -1.01 -0.01 0.08 0.00 0.00 0.00 175.76 174.79 3iuh s VAL 54 N -1.48 4.23 0.09 0.00 1.01 -0.40 -1.65 120.40 122.21 3iuh s VAL 54 Ca 0.69 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 62.11 3iuh s VAL 54 Cb -0.33 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 3iuh s VAL 54 CO 0.39 0.56 1.02 -2.16 0.00 0.00 0.00 175.10 174.90 3iuh s PRO 55 N -0.41 4.62 0.48 2.72 0.04 -1.25 -0.65 135.00 140.55 3iuh s PRO 55 Ca 0.07 1.53 0.14 0.00 0.04 0.00 0.00 61.00 62.79 3iuh s PRO 55 Cb -0.12 -3.37 1.14 0.00 0.04 0.00 0.00 34.50 32.19 3iuh s PRO 55 CO 0.02 0.07 2.09 0.66 0.04 0.00 0.00 177.00 179.89 3iuh h SER 56 N 5.90 0.17 0.19 6.66 4.64 -1.58 -0.16 113.55 129.37 3iuh h SER 56 Ca -0.43 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 3iuh h SER 56 Cb 1.21 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3iuh h SER 56 CO 0.74 0.12 -0.02 -2.67 -0.87 0.00 0.00 176.83 174.13 3iuh n TRP 57 N -4.50 0.00 0.18 4.77 2.14 -1.26 -3.67 117.44 115.10 3iuh n TRP 57 Ca 0.01 0.00 0.07 0.00 2.07 0.00 0.00 57.50 59.66 3iuh n TRP 57 Cb 0.16 -0.10 0.10 0.00 -0.81 0.00 0.00 31.31 30.67 3iuh n TRP 57 CO 0.00 0.00 0.00 0.78 2.07 0.00 0.00 177.69 180.54 3iuh h GLY 58 N 4.98 0.00 1.55 -1.67 0.00 -1.31 -3.29 103.07 103.33 3iuh h GLY 58 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3iuh h GLY 58 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 176.54 179.87 3iuh n VAL 59 N -3.16 0.01 -3.90 4.60 0.24 -1.24 -4.76 118.33 110.11 3iuh n VAL 59 Ca 0.03 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 62.03 3iuh n VAL 59 Cb 0.63 -0.50 -0.04 0.00 -1.47 0.00 0.00 33.84 32.46 3iuh n VAL 59 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3iuh s GLY 60 N -2.55 2.10 0.24 7.63 0.00 -1.24 -4.66 107.32 108.83 3iuh s GLY 60 Ca 0.29 -0.86 -0.30 0.00 0.00 0.00 0.00 44.72 43.85 3iuh s GLY 60 CO 0.46 -0.84 1.47 -1.59 0.00 0.00 0.00 173.10 172.60 3iuh s THR 61 N -1.57 2.63 0.74 0.90 2.01 -1.26 -4.64 115.64 114.45 3iuh s THR 61 Ca 0.35 0.51 -0.01 0.00 0.31 0.00 0.00 61.69 62.86 3iuh s THR 61 Cb -0.13 -3.33 0.15 0.00 0.01 0.00 0.00 72.50 69.21 3iuh s THR 61 CO 0.28 0.08 1.02 0.61 -0.69 0.00 0.00 174.62 175.91 3iuh n GLY 62 N 2.45 0.51 2.37 4.40 0.00 -0.20 -4.93 105.19 109.78 3iuh n GLY 62 Ca 0.08 -2.01 -0.07 0.00 0.00 0.00 0.00 46.02 44.02 3iuh n GLY 62 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iuh n GLY 63 N -2.69 1.61 3.69 -0.02 0.00 -1.26 -4.32 105.19 102.20 3iuh n GLY 63 Ca 0.16 -1.26 -0.31 0.00 0.00 0.00 0.00 46.02 44.62 3iuh n GLY 63 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3iuh s THR 64 N -2.48 0.88 -0.29 2.61 -4.23 -0.09 -4.99 115.64 107.05 3iuh s THR 64 Ca 0.12 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.89 3iuh s THR 64 Cb -0.03 -2.15 0.28 0.00 1.34 0.00 0.00 72.50 71.94 3iuh s THR 64 CO 0.09 0.00 1.78 0.08 -0.54 0.00 0.00 174.62 176.03 3iuh h ARG 65 N 1.45 0.00 0.00 3.99 0.11 -2.05 -2.84 114.38 115.04 3iuh h ARG 65 Ca -0.41 0.00 -0.27 0.00 0.10 0.00 0.00 59.98 59.41 3iuh h ARG 65 Cb 1.31 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.34 3iuh h ARG 65 CO 0.67 0.00 -1.55 0.74 0.10 0.00 0.00 179.97 179.93 3iuh h PHE 66 N 0.00 0.00 0.00 4.08 0.04 -2.05 -3.49 116.94 115.51 3iuh h PHE 66 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3iuh h PHE 66 Cb 0.33 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.48 3iuh h PHE 66 CO 0.00 0.96 0.00 0.00 -0.60 0.00 0.00 178.31 178.67 3iuh n ALA 67 N -2.50 0.00 -3.72 2.45 0.00 -1.07 -5.14 120.51 110.52 3iuh n ALA 67 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.10 3iuh n ALA 67 Cb 1.01 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 20.29 3iuh n ALA 67 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3iuh s ARG 68 N -2.00 0.41 -0.72 0.00 3.52 -1.26 -0.91 118.95 117.99 3iuh s ARG 68 Ca 0.00 0.14 -0.04 0.00 -0.13 0.00 0.00 55.73 55.71 3iuh s ARG 68 Cb 0.00 -0.76 0.18 0.00 -1.56 0.00 0.00 34.95 32.81 3iuh s ARG 68 CO 0.00 -0.26 0.57 -0.06 -0.81 0.00 0.00 175.30 174.74 3iuh s PHE 69 N 1.74 3.56 0.64 5.12 0.08 -1.26 -5.06 117.98 122.80 3iuh s PHE 69 Ca 0.01 -2.73 -0.18 0.00 0.12 0.00 0.00 56.93 54.15 3iuh s PHE 69 Cb -0.13 -3.27 -0.02 0.00 -0.57 0.00 0.00 43.02 39.03 3iuh s PHE 69 CO -0.04 -0.83 1.13 -0.35 -0.10 0.00 0.00 175.22 175.03 3iuh n PRO 70 N 3.21 0.95 -0.93 0.24 -0.04 -1.26 -4.95 135.00 132.23 3iuh n PRO 70 Ca 0.12 0.38 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 3iuh n PRO 70 Cb 0.38 -2.35 0.00 0.00 -0.04 0.00 0.00 33.50 31.49 3iuh n PRO 70 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3iuh n GLY 71 N 1.10 1.89 3.87 0.55 0.00 -1.26 -5.10 105.19 106.24 3iuh n GLY 71 Ca 0.15 -2.12 -0.31 0.00 0.00 0.00 0.00 46.02 43.75 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 1.04 4.77 -1.35 2.61 -4.23 -1.26 -4.19 115.64 113.02 3iuh s THR 72 Ca 0.00 0.66 -0.06 0.00 -1.18 0.00 0.00 61.69 61.12 3iuh s THR 72 Cb 0.00 -3.72 0.01 0.00 1.34 0.00 0.00 72.50 70.13 3iuh s THR 72 CO 0.00 -0.49 0.73 0.61 -0.54 0.00 0.00 174.62 174.92 3iuh n GLY 73 N -1.22 -0.41 3.73 3.99 0.00 -1.26 -4.77 105.19 105.25 3iuh n GLY 73 Ca 0.03 0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -5.79 4.14 0.05 1.61 0.41 -1.26 -4.73 118.70 113.14 3iuh s GLU 74 Ca 0.36 2.55 -0.31 0.00 -0.41 0.00 0.00 54.97 57.16 3iuh s GLU 74 Cb -0.16 -3.08 -0.06 0.00 -1.78 0.00 0.00 34.13 29.06 3iuh s GLU 74 CO 0.45 -0.69 1.23 -1.25 -0.49 0.00 0.00 175.26 174.50 3iuh s PRO 75 N 0.77 4.40 -0.23 0.39 0.04 -1.26 -4.94 135.00 134.17 3iuh s PRO 75 Ca 0.71 1.80 -0.02 0.00 0.04 0.00 0.00 61.00 63.52 3iuh s PRO 75 Cb -0.48 -3.38 0.01 0.00 0.04 0.00 0.00 34.50 30.69 3iuh s PRO 75 CO 0.36 -0.31 -0.07 1.03 0.04 0.00 0.00 177.00 178.05 3iuh s ARG 76 N 1.27 3.10 0.00 4.56 3.00 -1.26 -4.82 118.95 124.80 3iuh s ARG 76 Ca 0.59 -0.80 0.00 0.00 0.00 0.00 0.00 55.73 55.52 3iuh s ARG 76 Cb -0.30 -2.95 0.00 0.00 0.00 0.00 0.00 34.95 31.70 3iuh s ARG 76 CO 0.28 -0.29 0.00 0.41 0.00 0.00 0.00 175.30 175.71 3iuh n GLY 77 N 4.73 -0.43 0.22 -3.53 0.00 -1.26 -4.10 105.19 100.83 3iuh n GLY 77 Ca -0.18 -1.66 0.06 0.00 0.00 0.00 0.00 46.02 44.25 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 0.00 1.08 -0.44 -0.61 6.09 -1.89 -2.49 117.51 119.24 3iuh h ILE 78 Ca 0.00 -0.72 -0.11 0.00 -1.37 0.00 0.00 64.86 62.66 3iuh h ILE 78 Cb 0.00 1.39 -0.01 0.00 0.47 0.00 0.00 36.82 38.67 3iuh h ILE 78 CO 0.00 0.20 -0.17 -0.26 -3.07 0.00 0.00 178.15 174.85 3iuh h PHE 79 N 0.00 1.02 -0.72 2.19 0.04 -1.97 0.15 116.94 117.65 3iuh h PHE 79 Ca -0.00 -0.24 -0.06 0.00 2.80 0.00 0.00 57.97 60.46 3iuh h PHE 79 Cb 0.38 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 38.26 3iuh h PHE 79 CO 0.00 1.02 0.20 -0.44 -0.60 0.00 0.00 178.31 178.49 3iuh h ASP 80 N 0.72 1.07 -0.49 2.17 5.19 -1.66 -2.23 116.42 121.19 3iuh h ASP 80 Ca 0.10 -0.21 -0.09 0.00 -0.62 0.00 0.00 57.03 56.21 3iuh h ASP 80 Cb 0.73 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.94 3iuh h ASP 80 CO 0.06 1.01 -0.03 0.11 -3.12 0.00 0.00 179.24 177.27 3iuh h LYS 81 N 1.09 0.88 -0.66 3.56 1.57 -1.07 -2.37 116.57 119.57 3iuh h LYS 81 Ca 0.23 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 3iuh h LYS 81 Cb 0.34 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 3iuh h LYS 81 CO -0.00 0.93 0.20 -0.07 -0.57 0.00 0.00 179.45 179.94 3iuh h LEU 82 N 0.74 0.97 -1.22 2.94 3.38 -0.60 0.94 115.31 122.46 3iuh h LEU 82 Ca 0.14 -0.21 0.09 0.00 0.09 0.00 0.00 57.88 57.98 3iuh h LEU 82 Cb 0.55 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 3iuh h LEU 82 CO 0.03 0.92 0.56 0.44 0.09 0.00 0.00 178.44 180.49 3iuh h ASP 83 N 0.96 0.80 0.28 -0.43 3.32 -1.21 0.20 116.42 120.34 3iuh h ASP 83 Ca 0.21 0.02 -0.28 0.00 0.02 0.00 0.00 57.03 57.00 3iuh h ASP 83 Cb 0.31 -0.15 0.02 0.00 0.22 0.00 0.00 39.33 39.73 3iuh h ASP 83 CO -0.01 0.49 -1.19 0.44 -1.72 0.00 0.00 179.24 177.25 3iuh h ASP 84 N 0.89 0.72 -0.01 6.45 3.32 -0.88 -3.20 116.42 123.70 3iuh h ASP 84 Ca 0.39 -0.66 -0.04 0.00 0.02 0.00 0.00 57.03 56.74 3iuh h ASP 84 Cb 0.35 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 3iuh h ASP 84 CO -0.16 1.48 -0.09 0.00 -1.72 0.00 0.00 179.24 178.75 3iuh h ALA 86 N 1.68 1.58 -0.27 0.00 0.00 -0.63 -2.11 119.26 119.51 3iuh h ALA 86 Ca 0.05 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3iuh h ALA 86 Cb 0.32 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3iuh h ALA 86 CO 0.02 0.33 0.09 0.28 0.00 0.00 0.00 179.25 179.97 3iuh h VAL 87 N 0.51 1.19 -0.72 0.00 2.07 -1.37 -0.63 116.25 117.30 3iuh h VAL 87 Ca 0.13 -0.60 0.06 0.00 0.82 0.00 0.00 66.70 67.10 3iuh h VAL 87 Cb 0.10 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 3iuh h VAL 87 CO -0.01 0.20 0.42 0.40 0.02 0.00 0.00 177.57 178.60 3iuh h ILE 88 N 0.27 1.00 -0.24 4.57 2.04 -1.34 -2.10 117.51 121.73 3iuh h ILE 88 Ca 0.09 -0.27 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 3iuh h ILE 88 Cb 0.22 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 3iuh h ILE 88 CO -0.00 0.14 -0.07 -0.61 0.00 0.00 0.00 178.15 177.60 3iuh h GLN 89 N 0.78 0.47 -0.68 2.37 5.75 -1.22 -1.69 115.11 120.88 3iuh h GLN 89 Ca 0.31 -0.19 0.05 0.00 -0.15 0.00 0.00 58.65 58.68 3iuh h GLN 89 Cb 0.16 -0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.64 3iuh h GLN 89 CO -0.17 0.71 0.40 0.37 -2.65 0.00 0.00 178.83 177.49 3iuh h GLN 90 N 0.20 0.73 0.04 1.69 4.15 -0.81 0.50 115.11 121.60 3iuh h GLN 90 Ca 0.06 -0.04 -0.25 0.00 0.77 0.00 0.00 58.65 59.19 3iuh h GLN 90 Cb 0.55 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 3iuh h GLN 90 CO 0.03 0.48 -1.21 -0.07 -1.93 0.00 0.00 178.83 176.13 3iuh h LEU 91 N 0.75 0.14 0.00 -2.39 3.38 -1.40 -3.36 115.31 112.43 3iuh h LEU 91 Ca 0.29 -0.16 -0.18 0.00 0.09 0.00 0.00 57.88 57.92 3iuh h LEU 91 Cb 0.13 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 3iuh h LEU 91 CO -0.16 1.13 -1.94 0.35 0.09 0.00 0.00 178.44 177.92 3iuh n THR 92 N -3.36 0.68 -1.33 0.22 -2.24 -0.64 -1.29 114.28 106.32 3iuh n THR 92 Ca -0.06 -0.55 -0.11 0.00 -2.27 0.00 0.00 64.05 61.06 3iuh n THR 92 Cb 0.99 -0.35 -0.05 0.00 -2.10 0.00 0.00 70.33 68.82 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 -2.39 -1.66 0.00 -0.78 5.12 0.17 -4.79 116.66 112.33 3iuh n ARG 93 Ca -0.17 0.89 0.07 0.00 -1.93 0.00 0.00 57.85 56.71 3iuh n ARG 93 Cb 0.80 -5.30 0.02 0.00 -1.16 0.00 0.00 32.46 26.82 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 1.21 2.85 -2.94 7.54 0.00 -1.26 -4.71 120.51 123.20 3iuh n ALA 94 Ca -0.11 -0.54 -0.22 0.00 0.00 0.00 0.00 53.44 52.57 3iuh n ALA 94 Cb 0.59 -0.49 -0.02 0.00 0.00 0.00 0.00 19.45 19.52 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 0.18 1.65 0.30 0.00 -2.24 -1.26 -0.59 114.28 112.32 3iuh n THR 95 Ca 0.07 -4.91 0.18 0.00 -2.27 0.00 0.00 64.05 57.12 3iuh n THR 95 Cb 0.32 -0.78 0.87 0.00 -2.10 0.00 0.00 70.33 68.64 3iuh n THR 95 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3iuh h PRO 96 N 2.94 0.00 -6.67 -0.78 0.13 -1.84 -3.41 132.00 122.37 3iuh h PRO 96 Ca 0.12 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.58 3iuh h PRO 96 Cb 0.78 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 31.67 3iuh h PRO 96 CO 0.68 0.00 -0.87 -0.80 -0.23 0.00 0.00 178.00 176.78 3iuh s ASN 97 N -5.15 3.09 -0.04 1.44 0.01 -1.26 -0.41 114.94 112.62 3iuh s ASN 97 Ca -0.01 -0.64 0.05 0.00 -0.71 0.00 0.00 52.86 51.55 3iuh s ASN 97 Cb 0.10 -0.25 -0.02 0.00 0.41 0.00 0.00 41.25 41.49 3iuh s ASN 97 CO 0.44 0.21 -0.17 -0.69 -1.51 0.00 0.00 177.10 175.37 3iuh s VAL 98 N -0.91 2.79 -0.22 1.60 1.01 -0.06 -1.27 120.40 123.34 3iuh s VAL 98 Ca 0.12 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.14 3iuh s VAL 98 Cb -0.10 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 3iuh s VAL 98 CO 0.03 0.58 0.24 -0.44 0.00 0.00 0.00 175.10 175.51 3iuh s SER 99 N -0.72 6.24 0.29 3.32 0.01 0.18 -0.19 113.70 122.83 3iuh s SER 99 Ca 0.11 0.27 -0.06 0.00 1.31 0.00 0.00 55.95 57.58 3iuh s SER 99 Cb -0.10 -2.15 -0.05 0.00 0.21 0.00 0.00 66.02 63.93 3iuh s SER 99 CO 0.00 0.03 0.56 -0.76 0.41 0.00 0.00 173.24 173.49 3iuh s LEU 100 N 1.04 4.05 -0.12 2.44 1.02 -1.24 -1.35 118.68 124.53 3iuh s LEU 100 Ca 0.12 0.75 0.01 0.00 0.02 0.00 0.00 54.13 55.03 3iuh s LEU 100 Cb -0.14 -3.57 0.02 0.00 0.02 0.00 0.00 46.19 42.52 3iuh s LEU 100 CO 0.05 -0.20 -0.13 -2.28 0.02 0.00 0.00 176.35 173.82 3iuh s HIS 101 N -2.08 1.90 -0.10 0.29 2.46 -1.26 -0.85 115.29 115.65 3iuh s HIS 101 Ca 0.45 -0.97 -0.03 0.00 0.47 0.00 0.00 55.06 54.97 3iuh s HIS 101 Cb -0.11 -1.42 -0.03 0.00 -0.13 0.00 0.00 32.58 30.88 3iuh s HIS 101 CO 0.29 -0.55 0.02 0.42 -2.47 0.00 0.00 174.74 172.45 3iuh s ILE 102 N 1.34 4.44 -2.09 0.89 -1.09 -0.33 0.30 121.20 124.66 3iuh s ILE 102 Ca 0.00 -0.19 0.26 0.00 -2.23 0.00 0.00 60.65 58.49 3iuh s ILE 102 Cb -0.14 -2.89 0.71 0.00 -1.58 0.00 0.00 42.46 38.57 3iuh s ILE 102 CO -0.06 0.59 1.95 -0.81 -1.23 0.00 0.00 174.94 175.38 3iuh n PRO 103 N 2.30 1.14 -0.21 2.79 -0.04 -1.26 -2.28 135.00 137.43 3iuh n PRO 103 Ca -0.19 -0.21 -0.00 0.00 -0.04 0.00 0.00 63.50 63.06 3iuh n PRO 103 Cb 0.54 -1.42 0.11 0.00 -0.04 0.00 0.00 33.50 32.68 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 0.48 0.48 -0.57 0.54 6.55 -1.83 -2.65 115.95 118.96 3iuh h TRP 104 Ca 0.00 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.87 3iuh h TRP 104 Cb 0.10 -0.12 0.00 0.00 -0.86 0.00 0.00 29.16 28.28 3iuh h TRP 104 CO 0.01 0.16 0.00 -0.25 -1.05 0.00 0.00 178.44 177.30 3iuh n ASP 105 N -4.94 5.02 -4.69 -3.49 8.00 0.15 -4.65 116.55 111.95 3iuh n ASP 105 Ca 0.09 -2.67 -0.44 0.00 0.71 0.00 0.00 54.79 52.47 3iuh n ASP 105 Cb 0.26 -0.63 -0.04 0.00 -0.02 0.00 0.00 41.12 40.69 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 0.79 2.47 -3.65 -1.24 4.81 -1.00 -4.86 118.16 115.48 3iuh n LYS 106 Ca 0.25 0.89 -0.04 0.00 -0.87 0.00 0.00 58.31 58.54 3iuh n LYS 106 Cb 1.01 -2.70 -0.01 0.00 0.02 0.00 0.00 35.03 33.34 3iuh n LYS 106 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3iuh s ALA 107 N 1.13 -1.84 0.07 3.14 0.00 -1.26 -4.97 121.76 118.04 3iuh s ALA 107 Ca 0.77 0.59 -0.30 0.00 0.00 0.00 0.00 51.96 53.02 3iuh s ALA 107 Cb -0.59 0.47 -0.09 0.00 0.00 0.00 0.00 23.12 22.90 3iuh s ALA 107 CO 0.35 -0.91 1.87 0.34 0.00 0.00 0.00 175.76 177.41 3iuh s ASP 108 N -2.76 6.46 0.23 0.00 2.15 -1.26 -4.87 116.67 116.62 3iuh s ASP 108 Ca 0.10 2.67 -0.07 0.00 0.43 0.00 0.00 52.55 55.68 3iuh s ASP 108 Cb -0.00 -2.55 0.37 0.00 -0.30 0.00 0.00 42.92 40.44 3iuh s ASP 108 CO -0.02 -1.01 1.70 -0.65 -0.17 0.00 0.00 175.17 175.01 3iuh h PRO 109 N 9.47 0.27 -0.79 4.34 0.11 -1.95 -0.08 132.00 143.37 3iuh h PRO 109 Ca -0.47 -0.02 0.11 0.00 0.11 0.00 0.00 66.00 65.73 3iuh h PRO 109 Cb 1.22 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 32.22 3iuh h PRO 109 CO 0.94 0.18 0.51 0.87 -0.21 0.00 0.00 178.00 180.30 3iuh h LYS 110 N 0.27 0.65 -0.00 1.05 1.57 -1.89 0.17 116.57 118.39 3iuh h LYS 110 Ca 0.36 -0.04 -0.22 0.00 -1.87 0.00 0.00 60.65 58.89 3iuh h LYS 110 Cb 0.58 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 3iuh h LYS 110 CO -0.45 0.43 -0.91 0.93 -0.57 0.00 0.00 179.45 178.88 3iuh h GLU 111 N 0.67 0.37 0.15 3.15 5.08 -1.43 -2.12 114.58 120.45 3iuh h GLU 111 Ca 0.37 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3iuh h GLU 111 Cb 0.52 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.88 3iuh h GLU 111 CO -0.14 1.07 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.79 3iuh h LEU 112 N 0.21 -0.17 -0.53 1.33 3.38 -0.06 -0.55 115.31 118.92 3iuh h LEU 112 Ca -0.07 -0.18 0.07 0.00 0.09 0.00 0.00 57.88 57.79 3iuh h LEU 112 Cb 1.54 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 42.28 3iuh h LEU 112 CO 0.15 0.08 0.22 0.50 0.09 0.00 0.00 178.44 179.49 3iuh h LYS 113 N -0.43 0.42 -0.48 1.13 1.63 -0.78 -0.58 116.57 117.49 3iuh h LYS 113 Ca -0.02 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.74 3iuh h LYS 113 Cb 0.34 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.85 3iuh h LYS 113 CO 0.03 0.28 0.23 0.00 -3.45 0.00 0.00 179.45 176.54 3iuh h ALA 114 N 1.33 0.62 -0.46 5.00 0.00 -1.27 -0.81 119.26 123.68 3iuh h ALA 114 Ca 0.25 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3iuh h ALA 114 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3iuh h ALA 114 CO -0.23 0.18 -0.04 -0.09 0.00 0.00 0.00 179.25 179.08 3iuh h ARG 115 N 0.63 0.77 0.18 0.00 9.65 -0.62 -1.66 114.38 123.34 3iuh h ARG 115 Ca 0.16 -0.22 -0.01 0.00 -1.10 0.00 0.00 59.98 58.81 3iuh h ARG 115 Cb 0.12 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 28.62 3iuh h ARG 115 CO -0.02 0.81 -0.09 0.78 2.80 0.00 0.00 179.97 184.25 3iuh h GLY 116 N 0.97 -0.26 0.70 2.80 0.00 -0.81 -1.78 103.07 104.69 3iuh h GLY 116 Ca 0.13 0.10 0.10 0.00 0.00 0.00 0.00 47.33 47.66 3iuh h GLY 116 CO 0.03 -0.09 0.57 -0.55 0.00 0.00 0.00 176.54 176.49 3iuh h ASP 117 N -0.53 0.78 -0.31 0.19 3.32 -1.09 0.68 116.42 119.46 3iuh h ASP 117 Ca -0.03 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 3iuh h ASP 117 Cb 0.40 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 3iuh h ASP 117 CO 0.04 0.45 -0.03 0.00 -1.72 0.00 0.00 179.24 177.98 3iuh h ALA 118 N 1.56 1.18 0.00 3.45 0.00 -1.13 -3.01 119.26 121.32 3iuh h ALA 118 Ca 0.42 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3iuh h ALA 118 Cb 0.45 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3iuh h ALA 118 CO -0.18 0.53 -0.61 1.28 0.00 0.00 0.00 179.25 180.27 3iuh n LEU 119 N -4.22 0.62 0.00 0.00 4.77 -0.36 -4.94 117.00 112.87 3iuh n LEU 119 Ca 0.02 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 3iuh n LEU 119 Cb 0.30 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3iuh n LEU 119 CO 0.41 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 3iuh n GLY 120 N 1.39 0.94 3.40 -0.72 0.00 0.06 -4.93 105.19 105.33 3iuh n GLY 120 Ca 0.04 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 2.39 0.55 0.99 1.43 -0.19 -4.90 118.68 118.94 3iuh s LEU 121 Ca 0.00 -0.39 0.06 0.00 -1.03 0.00 0.00 54.13 52.77 3iuh s LEU 121 Cb 0.00 -1.44 0.04 0.00 0.03 0.00 0.00 46.19 44.83 3iuh s LEU 121 CO 0.00 0.31 0.46 -0.83 0.23 0.00 0.00 176.35 176.51 3iuh s GLY 122 N -0.90 2.28 -0.11 -3.19 0.00 0.45 -3.81 107.32 102.05 3iuh s GLY 122 Ca 0.12 -1.38 0.03 0.00 0.00 0.00 0.00 44.72 43.48 3iuh s GLY 122 CO 0.01 -1.91 -0.21 -1.36 0.00 0.00 0.00 173.10 169.64 3iuh s PHE 123 N -2.76 2.63 0.00 1.90 0.08 -1.26 -0.88 117.98 117.69 3iuh s PHE 123 Ca 0.38 -0.95 0.00 0.00 0.12 0.00 0.00 56.93 56.48 3iuh s PHE 123 Cb -0.03 -1.75 0.00 0.00 -0.57 0.00 0.00 43.02 40.67 3iuh s PHE 123 CO 0.24 -0.37 0.00 -3.47 -0.10 0.00 0.00 175.22 171.51 3iuh n ASP 124 N 3.54 0.00 -4.68 1.36 2.03 0.74 -4.19 116.55 115.35 3iuh n ASP 124 Ca -0.19 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.70 3iuh n ASP 124 Cb 0.53 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.92 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 1.02 -1.86 -1.67 0.00 -1.26 -4.59 120.51 109.15 3iuh n ALA 125 Ca 0.00 0.35 -0.33 0.00 0.00 0.00 0.00 53.44 53.46 3iuh n ALA 125 Cb 0.00 -2.21 -0.07 0.00 0.00 0.00 0.00 19.45 17.17 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 -1.88 4.21 -0.15 0.00 -1.94 0.11 -3.63 119.30 116.03 3iuh s MET 126 Ca 0.57 1.07 0.00 0.00 -1.71 0.00 0.00 55.69 55.62 3iuh s MET 126 Cb -0.58 -2.23 0.02 0.00 2.01 0.00 0.00 34.83 34.05 3iuh s MET 126 CO 0.61 0.00 -0.13 -0.80 -0.01 0.00 0.00 175.02 174.70 3iuh s ASN 127 N -2.17 2.66 0.56 3.03 0.01 -0.03 -0.18 114.94 118.81 3iuh s ASN 127 Ca 0.61 -0.48 -0.07 0.00 -0.71 0.00 0.00 52.86 52.20 3iuh s ASN 127 Cb -0.09 -1.13 -0.02 0.00 0.41 0.00 0.00 41.25 40.41 3iuh s ASN 127 CO 0.14 -0.07 0.90 -0.94 -1.51 0.00 0.00 177.10 175.62 3iuh s SER 128 N 1.51 6.04 -0.33 -1.22 1.04 -1.19 -1.19 113.70 118.38 3iuh s SER 128 Ca 0.05 1.03 -0.01 0.00 0.48 0.00 0.00 55.95 57.49 3iuh s SER 128 Cb -0.13 -2.16 0.11 0.00 0.10 0.00 0.00 66.02 63.94 3iuh s SER 128 CO -0.10 -0.82 0.13 0.21 0.98 0.00 0.00 173.24 173.64 3iuh s ASN 129 N -4.19 3.78 -0.21 7.02 3.84 -0.97 -4.72 114.94 119.49 3iuh s ASN 129 Ca 0.52 -1.76 0.14 0.00 0.21 0.00 0.00 52.86 51.97 3iuh s ASN 129 Cb -0.11 -0.74 0.45 0.00 -0.55 0.00 0.00 41.25 40.31 3iuh s ASN 129 CO 0.48 -0.39 1.18 0.35 -2.79 0.00 0.00 177.10 175.93 3iuh n THR 130 N 4.67 1.81 -0.20 -5.21 -2.24 -1.26 -4.64 114.28 107.20 3iuh n THR 130 Ca 0.00 -3.18 0.03 0.00 -2.27 0.00 0.00 64.05 58.63 3iuh n THR 130 Cb 0.40 -0.08 0.06 0.00 -2.10 0.00 0.00 70.33 68.61 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 -0.62 0.13 -3.55 4.78 1.16 -1.26 -4.58 117.46 113.51 3iuh n PHE 131 Ca 0.24 -0.58 -0.11 0.00 -1.87 0.00 0.00 57.45 55.13 3iuh n PHE 131 Cb 0.88 -0.07 -0.04 0.00 -1.61 0.00 0.00 39.48 38.65 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 -1.27 -0.37 -0.14 5.98 1.04 -1.26 -4.91 113.70 112.78 3iuh s SER 132 Ca 0.10 -0.18 -0.07 0.00 0.48 0.00 0.00 55.95 56.29 3iuh s SER 132 Cb 0.07 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.67 3iuh s SER 132 CO 0.04 -0.89 0.11 -1.81 0.98 0.00 0.00 173.24 171.67 3iuh s ASP 133 N -2.74 6.11 0.08 7.02 1.01 -1.26 -4.81 116.67 122.07 3iuh s ASP 133 Ca 0.02 0.34 0.00 0.00 0.71 0.00 0.00 52.55 53.62 3iuh s ASP 133 Cb 0.01 -1.98 -0.04 0.00 1.01 0.00 0.00 42.92 41.92 3iuh s ASP 133 CO -0.12 0.34 0.23 0.00 0.21 0.00 0.00 175.17 175.83 3iuh s ALA 134 N -0.60 3.99 0.39 5.23 0.00 -1.26 -5.06 121.76 124.45 3iuh s ALA 134 Ca 0.12 -0.85 -0.27 0.00 0.00 0.00 0.00 51.96 50.97 3iuh s ALA 134 Cb -0.12 -1.84 -0.11 0.00 0.00 0.00 0.00 23.12 21.05 3iuh s ALA 134 CO 0.02 0.78 1.30 -2.30 0.00 0.00 0.00 175.76 175.56 3iuh n PRO 135 N 0.17 2.07 -0.79 0.00 -0.02 -1.26 -2.00 135.00 133.17 3iuh n PRO 135 Ca -0.05 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 3iuh n PRO 135 Cb 0.51 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 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 0.76 1.04 3.72 -1.23 0.00 -1.26 -4.98 105.19 103.25 3iuh n GLY 136 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3iuh n GLY 136 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3iuh n GLN 137 N -2.00 2.66 0.04 1.61 7.27 -0.85 -4.92 117.38 121.19 3iuh n GLN 137 Ca 0.00 0.95 -0.13 0.00 0.07 0.00 0.00 57.00 57.90 3iuh n GLN 137 Cb 0.00 -2.76 -0.09 0.00 2.41 0.00 0.00 30.24 29.81 3iuh n GLN 137 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3iuh h ALA 138 N 5.70 -0.07 -4.09 1.69 0.00 -1.93 -3.44 119.26 117.12 3iuh h ALA 138 Ca -0.45 -0.15 -0.69 0.00 0.00 0.00 0.00 54.91 53.63 3iuh h ALA 138 Cb 1.22 0.03 -0.28 0.00 0.00 0.00 0.00 17.79 18.76 3iuh h ALA 138 CO 0.87 -0.40 -0.84 -1.01 0.00 0.00 0.00 179.25 177.87 3iuh s HIS 139 N -5.06 2.53 0.36 0.00 3.76 -1.26 -5.12 115.29 110.50 3iuh s HIS 139 Ca -0.15 -0.48 -0.24 0.00 -0.15 0.00 0.00 55.06 54.05 3iuh s HIS 139 Cb 0.03 -1.61 -0.10 0.00 1.11 0.00 0.00 32.58 32.01 3iuh s HIS 139 CO 0.65 -0.05 0.93 0.45 -0.85 0.00 0.00 174.74 175.87 3iuh s SER 140 N -0.38 7.17 -0.14 1.40 0.15 -1.26 -4.97 113.70 115.66 3iuh s SER 140 Ca 0.03 1.75 0.14 0.00 0.70 0.00 0.00 55.95 58.57 3iuh s SER 140 Cb -0.12 -2.55 0.65 0.00 -1.71 0.00 0.00 66.02 62.29 3iuh s SER 140 CO 0.02 -0.17 1.53 -1.22 1.20 0.00 0.00 173.24 174.60 3iuh n TYR 141 N 0.11 1.50 -0.27 3.44 4.01 -1.26 -4.56 117.16 120.13 3iuh n TYR 141 Ca 0.04 -0.56 0.07 0.00 -0.16 0.00 0.00 57.90 57.29 3iuh n TYR 141 Cb 0.52 -0.32 0.21 0.00 -0.31 0.00 0.00 39.34 39.43 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 3.46 0.44 -0.53 -0.72 3.64 -1.95 -1.64 116.57 119.27 3iuh h LYS 142 Ca 0.00 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 3iuh h LYS 142 Cb 1.49 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 33.16 3iuh h LYS 142 CO 0.30 0.29 0.09 0.66 -2.27 0.00 0.00 179.45 178.52 3iuh n TYR 143 N -5.00 1.82 0.00 1.91 4.01 -1.26 -5.05 117.16 113.59 3iuh n TYR 143 Ca 0.16 -1.01 0.00 0.00 -0.16 0.00 0.00 57.90 56.88 3iuh n TYR 143 Cb 0.45 -0.52 0.00 0.00 -0.31 0.00 0.00 39.34 38.96 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 -0.12 1.27 0.00 2.72 0.00 -0.62 -4.67 105.19 103.77 3iuh n GLY 144 Ca 0.31 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 44.11 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 0.29 1.61 3.41 -1.26 -4.28 113.62 113.39 3iuh n SER 145 Ca 0.00 0.00 0.17 0.00 -0.26 0.00 0.00 58.87 58.78 3iuh n SER 145 Cb 0.00 0.00 0.87 0.00 -0.26 0.00 0.00 64.21 64.82 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 -2.97 1.04 3.38 -1.87 -2.52 115.31 112.37 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 0.05 0.00 -1.54 0.09 0.00 0.00 178.44 177.04 3iuh n SER 147 N -3.35 2.72 -4.72 -0.43 3.41 -1.26 -3.88 113.62 106.12 3iuh n SER 147 Ca -0.02 -2.19 -0.39 0.00 -0.26 0.00 0.00 58.87 56.02 3iuh n SER 147 Cb 0.20 -0.21 0.04 0.00 -0.26 0.00 0.00 64.21 63.98 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 -0.03 2.09 0.25 7.33 -0.00 -0.95 -4.76 115.22 119.15 3iuh n HIS 148 Ca 0.09 0.44 0.13 0.00 -0.00 0.00 0.00 57.72 58.39 3iuh n HIS 148 Cb 0.44 -2.33 0.63 0.00 -0.00 0.00 0.00 29.99 28.73 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 1.34 0.40 -3.29 3.57 1.35 -1.91 -3.42 112.91 110.94 3iuh h THR 149 Ca -0.50 -0.75 -0.60 0.00 -0.55 0.00 0.00 66.41 64.01 3iuh h THR 149 Cb 1.31 1.54 -0.09 0.00 -1.73 0.00 0.00 68.15 69.19 3iuh h THR 149 CO 0.56 0.13 0.45 0.21 -0.25 0.00 0.00 175.52 176.63 3iuh s ASN 150 N -6.01 6.82 0.16 5.36 2.47 -1.26 -4.97 114.94 117.51 3iuh s ASN 150 Ca -0.01 1.02 -0.17 0.00 0.42 0.00 0.00 52.86 54.12 3iuh s ASN 150 Cb 0.11 -2.43 0.08 0.00 -1.45 0.00 0.00 41.25 37.56 3iuh s ASN 150 CO 0.59 -0.51 1.68 0.00 -3.72 0.00 0.00 177.10 175.14 3iuh h ALA 151 N 7.69 0.28 0.00 1.71 0.00 -1.99 -1.59 119.26 125.36 3iuh h ALA 151 Ca -0.23 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3iuh h ALA 151 Cb 1.09 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 3iuh h ALA 151 CO 0.87 -0.43 -0.03 0.00 0.00 0.00 0.00 179.25 179.66 3iuh h ALA 152 N 1.35 1.72 -0.11 0.00 0.00 -1.96 -1.07 119.26 119.18 3iuh h ALA 152 Ca 0.18 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.90 3iuh h ALA 152 Cb 0.27 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.06 3iuh h ALA 152 CO -0.35 0.03 -0.57 1.15 0.00 0.00 0.00 179.25 179.52 3iuh h THR 153 N 0.00 1.34 -0.56 0.00 2.02 -1.66 -1.77 112.91 112.29 3iuh h THR 153 Ca -0.00 -1.86 -0.05 0.00 0.77 0.00 0.00 66.41 65.27 3iuh h THR 153 Cb 0.06 2.15 -0.02 0.00 -1.74 0.00 0.00 68.15 68.59 3iuh h THR 153 CO 0.00 0.57 0.16 0.03 0.37 0.00 0.00 175.52 176.65 3iuh h ARG 154 N 0.22 0.89 -0.96 6.66 3.08 -0.97 -1.27 114.38 122.04 3iuh h ARG 154 Ca -0.04 -0.20 0.01 0.00 0.07 0.00 0.00 59.98 59.82 3iuh h ARG 154 Cb 1.21 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 31.09 3iuh h ARG 154 CO 0.12 0.81 0.63 0.00 -1.07 0.00 0.00 179.97 180.47 3iuh h ALA 155 N 1.03 1.22 -0.55 0.04 0.00 -1.20 0.30 119.26 120.11 3iuh h ALA 155 Ca 0.18 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 3iuh h ALA 155 Cb 0.31 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3iuh h ALA 155 CO -0.00 0.60 0.11 0.37 0.00 0.00 0.00 179.25 180.33 3iuh h GLN 156 N 1.29 0.89 -0.39 0.00 4.15 -0.99 0.11 115.11 120.17 3iuh h GLN 156 Ca 0.36 -0.23 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 3iuh h GLN 156 Cb -0.13 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.43 3iuh h GLN 156 CO -0.08 0.85 0.20 0.00 -1.93 0.00 0.00 178.83 177.87 3iuh h ALA 157 N 1.00 0.50 -0.45 3.38 0.00 -0.11 -1.20 119.26 122.38 3iuh h ALA 157 Ca 0.17 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3iuh h ALA 157 Cb 0.37 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3iuh h ALA 157 CO 0.01 0.04 0.18 0.28 0.00 0.00 0.00 179.25 179.76 3iuh h VAL 158 N 0.49 1.20 -0.48 0.00 2.07 -0.18 -2.15 116.25 117.21 3iuh h VAL 158 Ca 0.13 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 3iuh h VAL 158 Cb 0.09 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 3iuh h VAL 158 CO -0.02 0.23 0.23 -0.08 0.02 0.00 0.00 177.57 177.95 3iuh h GLU 159 N 0.59 0.67 -0.46 1.57 4.57 -0.56 -0.90 114.58 120.05 3iuh h GLU 159 Ca 0.15 -0.08 -0.08 0.00 -1.18 0.00 0.00 59.36 58.17 3iuh h GLU 159 Cb 0.19 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 3iuh h GLU 159 CO -0.01 0.52 -0.03 1.25 -1.18 0.00 0.00 179.01 179.55 3iuh h HIS 160 N 0.67 0.93 -0.51 0.92 2.76 -0.83 -1.31 115.15 117.78 3iuh h HIS 160 Ca 0.17 -0.17 -0.09 0.00 -2.20 0.00 0.00 60.37 58.07 3iuh h HIS 160 Cb 0.07 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 28.77 3iuh h HIS 160 CO 0.01 0.90 -0.05 -0.91 -1.30 0.00 0.00 177.93 176.57 3iuh h ASN 161 N 0.69 0.87 -0.06 3.26 2.35 -0.90 -1.53 115.58 120.26 3iuh h ASN 161 Ca 0.13 -0.25 -0.04 0.00 -0.55 0.00 0.00 56.30 55.59 3iuh h ASN 161 Cb 0.55 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 3iuh h ASN 161 CO 0.03 0.96 -0.07 -0.07 -1.65 0.00 0.00 177.43 176.63 3iuh h LEU 162 N 0.81 0.28 -0.83 1.61 3.38 -0.99 -1.20 115.31 118.37 3iuh h LEU 162 Ca 0.14 -0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.94 3iuh h LEU 162 Cb 0.56 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3iuh h LEU 162 CO 0.03 0.39 -0.44 -0.08 0.09 0.00 0.00 178.44 178.43 3iuh h GLU 163 N 0.29 0.31 -0.31 1.13 4.81 -0.49 -2.16 114.58 118.16 3iuh h GLU 163 Ca 0.06 -0.16 -0.10 0.00 -0.13 0.00 0.00 59.36 59.03 3iuh h GLU 163 Cb 0.32 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 3iuh h GLU 163 CO 0.01 0.70 -0.23 0.00 -0.73 0.00 0.00 179.01 178.77 3iuh h ILE 165 N 0.53 1.27 -0.19 0.00 2.04 -0.95 -0.32 117.51 119.88 3iuh h ILE 165 Ca 0.08 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 64.83 3iuh h ILE 165 Cb 0.68 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 3iuh h ILE 165 CO 0.05 0.40 0.05 -0.33 0.00 0.00 0.00 178.15 178.33 3iuh h GLU 166 N 1.01 0.30 -0.50 2.37 4.39 -1.10 0.04 114.58 121.09 3iuh h GLU 166 Ca 0.19 -0.07 0.02 0.00 0.34 0.00 0.00 59.36 59.84 3iuh h GLU 166 Cb 0.50 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.08 3iuh h GLU 166 CO 0.02 0.42 0.31 0.82 -1.16 0.00 0.00 179.01 179.42 3iuh h ILE 167 N 0.13 1.08 -0.80 3.13 2.04 -1.18 -2.40 117.51 119.50 3iuh h ILE 167 Ca 0.06 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.71 3iuh h ILE 167 Cb 0.25 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.69 3iuh h ILE 167 CO -0.00 0.11 0.51 1.23 0.00 0.00 0.00 178.15 180.00 3iuh h GLY 168 N 0.62 1.14 1.61 5.37 0.00 -0.80 -2.17 103.07 108.85 3iuh h GLY 168 Ca 0.19 -0.45 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 3iuh h GLY 168 CO -0.07 0.44 0.03 0.50 0.00 0.00 0.00 176.54 177.43 3iuh h LYS 169 N 1.09 0.50 0.00 4.80 1.57 -0.49 -0.39 116.57 123.65 3iuh h LYS 169 Ca 0.29 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.98 3iuh h LYS 169 Cb -0.08 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.15 3iuh h LYS 169 CO -0.06 0.50 -0.01 0.00 -0.57 0.00 0.00 179.45 179.32 3iuh h ALA 170 N 1.56 1.00 -0.15 3.86 0.00 -1.09 -3.31 119.26 121.11 3iuh h ALA 170 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3iuh h ALA 170 Cb 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3iuh h ALA 170 CO 0.00 0.01 0.00 0.44 0.00 0.00 0.00 179.25 179.70 3iuh n ILE 171 N -3.10 0.59 0.00 0.00 -5.35 -1.03 -4.85 119.36 105.61 3iuh n ILE 171 Ca 0.02 -0.79 0.00 0.00 -0.27 0.00 0.00 62.75 61.71 3iuh n ILE 171 Cb 0.42 0.78 0.00 0.00 -1.74 0.00 0.00 39.64 39.10 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 0.33 0.73 3.79 3.28 0.00 -1.04 -4.55 105.19 107.74 3iuh n GLY 172 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.53 5.94 -0.07 1.61 0.15 -0.18 -4.84 113.70 113.79 3iuh s SER 173 Ca 0.00 1.92 0.12 0.00 0.70 0.00 0.00 55.95 58.69 3iuh s SER 173 Cb 0.00 -2.55 0.22 0.00 -1.71 0.00 0.00 66.02 61.97 3iuh s SER 173 CO 0.00 -1.06 1.10 0.29 1.20 0.00 0.00 173.24 174.78 3iuh n LYS 174 N -1.54 0.60 -3.56 5.44 4.76 -1.26 -4.47 118.16 118.12 3iuh n LYS 174 Ca 0.09 -1.95 -0.13 0.00 -2.87 0.00 0.00 58.31 53.46 3iuh n LYS 174 Cb 0.52 -0.87 -0.05 0.00 -1.84 0.00 0.00 35.03 32.79 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 -1.30 -1.89 -0.18 7.82 0.00 -1.26 -2.13 121.76 122.81 3iuh s ALA 175 Ca 0.20 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.69 3iuh s ALA 175 Cb 0.20 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.79 3iuh s ALA 175 CO -0.03 -0.32 -0.17 -1.17 0.00 0.00 0.00 175.76 174.07 3iuh s LEU 176 N -1.08 2.28 -0.18 0.00 2.96 -0.64 0.09 118.68 122.12 3iuh s LEU 176 Ca -0.04 -0.60 -0.13 0.00 -0.22 0.00 0.00 54.13 53.15 3iuh s LEU 176 Cb -0.00 -1.53 -0.05 0.00 0.50 0.00 0.00 46.19 45.11 3iuh s LEU 176 CO 0.04 0.00 0.25 -0.89 -1.32 0.00 0.00 176.35 174.43 3iuh s THR 177 N 1.29 5.33 -0.27 3.68 2.01 0.74 -0.91 115.64 127.52 3iuh s THR 177 Ca 0.04 0.44 0.03 0.00 0.31 0.00 0.00 61.69 62.51 3iuh s THR 177 Cb -0.13 -3.59 0.06 0.00 0.01 0.00 0.00 72.50 68.85 3iuh s THR 177 CO -0.10 0.39 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.45 3iuh s VAL 178 N 0.52 2.06 -0.14 3.82 1.01 0.11 -3.14 120.40 124.64 3iuh s VAL 178 Ca 0.14 -1.65 0.02 0.00 0.00 0.00 0.00 61.98 60.49 3iuh s VAL 178 Cb -0.13 -2.24 0.02 0.00 0.00 0.00 0.00 36.38 34.03 3iuh s VAL 178 CO 0.02 -0.11 -0.18 0.86 0.00 0.00 0.00 175.10 175.69 3iuh s TRP 179 N 1.13 2.36 0.25 5.22 -0.00 -1.26 -2.08 118.94 124.56 3iuh s TRP 179 Ca -0.06 -1.23 0.08 0.00 -0.00 0.00 0.00 56.10 54.90 3iuh s TRP 179 Cb -0.20 -1.66 -0.05 0.00 -0.00 0.00 0.00 33.47 31.56 3iuh s TRP 179 CO -0.06 -0.60 -0.13 0.96 -0.00 0.00 0.00 176.95 177.12 3iuh s ILE 180 N 1.05 1.86 -0.96 5.86 -4.36 -1.26 -4.73 121.20 118.66 3iuh s ILE 180 Ca -0.03 -2.22 0.25 0.00 -0.26 0.00 0.00 60.65 58.39 3iuh s ILE 180 Cb -0.14 -2.24 -0.00 0.00 1.25 0.00 0.00 42.46 41.33 3iuh s ILE 180 CO -0.05 -0.46 1.37 0.61 0.24 0.00 0.00 174.94 176.66 3iuh n GLY 181 N -0.50 -1.25 2.27 6.27 0.00 -1.26 -4.97 105.19 105.74 3iuh n GLY 181 Ca -0.07 -0.35 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.56 0.47 0.00 1.61 9.92 -1.26 -4.17 116.55 121.55 3iuh n ASP 182 Ca 0.05 0.73 0.00 0.00 -0.53 0.00 0.00 54.79 55.04 3iuh n ASP 182 Cb 0.35 -0.56 0.00 0.00 -0.64 0.00 0.00 41.12 40.27 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 1.90 -0.59 3.10 0.44 0.00 -1.26 -1.90 105.19 106.88 3iuh n GLY 183 Ca 0.17 -0.67 -0.08 0.00 0.00 0.00 0.00 46.02 45.44 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 0.33 0.00 1.61 1.04 0.91 -4.87 113.70 108.72 3iuh s SER 184 Ca 0.00 -0.78 0.13 0.00 0.48 0.00 0.00 55.95 55.78 3iuh s SER 184 Cb 0.00 0.21 -0.01 0.00 0.10 0.00 0.00 66.02 66.32 3iuh s SER 184 CO 0.00 -0.55 0.73 0.59 0.98 0.00 0.00 173.24 174.99 3iuh n ASN 185 N 0.45 1.38 -3.89 7.02 4.13 -1.26 -1.49 115.26 121.61 3iuh n ASN 185 Ca -0.17 -1.19 -0.11 0.00 1.68 0.00 0.00 54.58 54.79 3iuh n ASN 185 Cb 0.60 0.48 -0.13 0.00 -1.54 0.00 0.00 39.78 39.18 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 -1.61 0.03 0.38 3.10 0.08 -1.26 -4.44 117.98 114.26 3iuh s PHE 186 Ca 0.10 -0.06 -0.28 0.00 0.12 0.00 0.00 56.93 56.82 3iuh s PHE 186 Cb 0.10 -0.03 -0.11 0.00 -0.57 0.00 0.00 43.02 42.41 3iuh s PHE 186 CO 0.32 -0.05 1.43 -2.30 -0.10 0.00 0.00 175.22 174.52 3iuh n PRO 187 N 2.75 2.49 0.00 0.24 -0.02 -1.26 -1.71 135.00 137.49 3iuh n PRO 187 Ca -0.15 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 3iuh n PRO 187 Cb 0.59 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 3iuh n PRO 187 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3iuh n GLY 188 N 0.54 2.98 0.24 -1.23 0.00 -1.26 -4.87 105.19 101.59 3iuh n GLY 188 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.04 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 1.02 0.48 -6.74 1.61 4.15 -1.77 -3.42 115.11 110.45 3iuh h GLN 189 Ca 0.00 -0.03 -0.67 0.00 0.77 0.00 0.00 58.65 58.72 3iuh h GLN 189 Cb 0.00 -0.11 -0.19 0.00 0.21 0.00 0.00 27.48 27.39 3iuh h GLN 189 CO 0.00 0.32 -0.82 -1.12 -1.93 0.00 0.00 178.83 175.28 3iuh s SER 190 N -5.45 3.65 -0.46 -0.69 0.01 -1.26 -5.08 113.70 104.42 3iuh s SER 190 Ca -0.13 -0.68 -0.17 0.00 1.31 0.00 0.00 55.95 56.28 3iuh s SER 190 Cb 0.17 -0.40 0.05 0.00 0.21 0.00 0.00 66.02 66.04 3iuh s SER 190 CO 0.75 0.16 0.45 0.21 0.41 0.00 0.00 173.24 175.22 3iuh s ASN 191 N -2.29 6.18 0.24 2.44 3.84 -1.26 -4.96 114.94 119.12 3iuh s ASN 191 Ca 0.18 -0.97 -0.15 0.00 0.21 0.00 0.00 52.86 52.14 3iuh s ASN 191 Cb -0.10 -2.22 0.30 0.00 -0.55 0.00 0.00 41.25 38.68 3iuh s ASN 191 CO 0.09 -0.66 1.57 -0.26 -2.79 0.00 0.00 177.10 175.05 3iuh h PHE 192 N 8.79 -0.82 -0.11 0.43 0.04 -1.98 -0.84 116.94 122.46 3iuh h PHE 192 Ca -0.27 0.09 -0.02 0.00 2.80 0.00 0.00 57.97 60.56 3iuh h PHE 192 Cb 1.11 0.49 -0.00 0.00 2.20 0.00 0.00 35.95 39.75 3iuh h PHE 192 CO 0.65 -0.40 -0.03 1.15 -0.60 0.00 0.00 178.31 179.08 3iuh h THR 193 N -0.02 1.29 -0.67 -1.55 2.02 -1.99 -2.56 112.91 109.42 3iuh h THR 193 Ca 0.37 -0.97 -0.04 0.00 0.77 0.00 0.00 66.41 66.54 3iuh h THR 193 Cb 0.62 1.72 -0.03 0.00 -1.74 0.00 0.00 68.15 68.72 3iuh h THR 193 CO -0.93 0.28 0.25 0.03 0.37 0.00 0.00 175.52 175.52 3iuh h ARG 194 N -0.11 1.00 -0.48 6.66 3.08 -1.88 0.42 114.38 123.07 3iuh h ARG 194 Ca 0.03 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 3iuh h ARG 194 Cb 0.44 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 3iuh h ARG 194 CO 0.01 0.82 0.24 0.00 -1.07 0.00 0.00 179.97 179.98 3iuh h ALA 195 N 1.30 0.61 -0.20 0.04 0.00 -1.18 -0.77 119.26 119.07 3iuh h ALA 195 Ca 0.22 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 3iuh h ALA 195 Cb 0.21 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3iuh h ALA 195 CO -0.02 0.16 -0.29 0.35 0.00 0.00 0.00 179.25 179.45 3iuh h PHE 196 N 0.63 0.44 -0.52 0.00 3.57 -1.01 -0.50 116.94 119.55 3iuh h PHE 196 Ca 0.17 -0.10 -0.10 0.00 3.53 0.00 0.00 57.97 61.47 3iuh h PHE 196 Cb 0.09 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 3iuh h PHE 196 CO -0.01 0.64 -0.05 0.93 -2.23 0.00 0.00 178.31 177.59 3iuh h GLU 197 N 0.34 0.95 -0.61 1.11 5.08 -0.52 -0.60 114.58 120.34 3iuh h GLU 197 Ca 0.05 -0.33 -0.07 0.00 -1.00 0.00 0.00 59.36 58.01 3iuh h GLU 197 Cb 0.68 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 3iuh h GLU 197 CO 0.05 0.99 0.11 0.00 -1.00 0.00 0.00 179.01 179.17 3iuh h ARG 198 N 0.82 0.99 -0.09 2.33 3.08 -0.79 -1.64 114.38 119.09 3iuh h ARG 198 Ca 0.14 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 3iuh h ARG 198 Cb 0.60 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 3iuh h ARG 198 CO 0.04 0.93 0.05 -0.92 -1.07 0.00 0.00 179.97 178.99 3iuh h TYR 199 N 0.90 0.12 -0.98 3.04 5.03 -0.84 -1.77 116.97 122.46 3iuh h TYR 199 Ca 0.19 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.50 3iuh h TYR 199 Cb 0.40 -0.04 -0.05 0.00 1.55 0.00 0.00 36.73 38.60 3iuh h TYR 199 CO 0.03 0.13 0.63 -0.07 -1.32 0.00 0.00 178.16 177.55 3iuh h LEU 200 N 0.07 1.14 -0.51 2.82 3.38 -0.97 -0.51 115.31 120.74 3iuh h LEU 200 Ca 0.03 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 3iuh h LEU 200 Cb 0.05 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 3iuh h LEU 200 CO -0.01 0.85 0.04 -1.28 0.09 0.00 0.00 178.44 178.13 3iuh h SER 201 N 1.33 0.84 -0.37 -0.43 0.87 -1.13 -1.76 113.55 112.90 3iuh h SER 201 Ca 0.36 -0.28 -0.06 0.00 -1.23 0.00 0.00 61.79 60.57 3iuh h SER 201 Cb -0.12 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.61 3iuh h SER 201 CO -0.07 0.91 -0.00 0.00 -0.53 0.00 0.00 176.83 177.14 3iuh h ALA 202 N 0.96 0.50 0.00 6.23 0.00 -0.91 -2.81 119.26 123.23 3iuh h ALA 202 Ca 0.15 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3iuh h ALA 202 Cb 0.46 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3iuh h ALA 202 CO 0.02 0.27 -0.20 0.52 0.00 0.00 0.00 179.25 179.87 3iuh h MET 203 N 0.48 0.00 -0.58 0.00 2.07 -1.03 -1.62 114.93 114.25 3iuh h MET 203 Ca 0.11 0.00 -0.07 0.00 -2.07 0.00 0.00 59.70 57.67 3iuh h MET 203 Cb 0.47 0.00 -0.02 0.00 -1.87 0.00 0.00 31.60 30.17 3iuh h MET 203 CO 0.02 0.20 0.09 0.00 1.07 0.00 0.00 176.91 178.28 3iuh h ALA 204 N 1.80 1.06 -0.38 6.32 0.00 -1.06 0.61 119.26 127.62 3iuh h ALA 204 Ca -0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 3iuh h ALA 204 Cb 0.38 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3iuh h ALA 204 CO 0.03 0.61 0.10 0.93 0.00 0.00 0.00 179.25 180.91 3iuh h GLU 205 N 0.89 0.61 -0.77 0.00 5.08 -1.16 -1.74 114.58 117.48 3iuh h GLU 205 Ca 0.18 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 3iuh h GLU 205 Cb 0.40 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.53 3iuh h GLU 205 CO 0.01 0.64 0.36 0.82 -1.00 0.00 0.00 179.01 179.84 3iuh h ILE 206 N 0.47 1.25 -0.70 3.13 2.04 -1.15 -2.45 117.51 120.09 3iuh h ILE 206 Ca 0.12 -0.70 0.04 0.00 1.00 0.00 0.00 64.86 65.32 3iuh h ILE 206 Cb 0.30 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 3iuh h ILE 206 CO 0.00 0.29 0.46 0.22 0.00 0.00 0.00 178.15 179.13 3iuh h TYR 207 N 1.09 0.80 0.00 1.37 5.03 -0.49 -1.01 116.97 123.75 3iuh h TYR 207 Ca 0.26 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.57 3iuh h TYR 207 Cb 0.13 -0.27 -0.00 0.00 1.55 0.00 0.00 36.73 38.14 3iuh h TYR 207 CO 0.01 0.46 -0.12 0.87 -1.32 0.00 0.00 178.16 178.06 3iuh h LYS 208 N 0.82 0.00 -0.31 1.82 1.57 -0.83 -2.26 116.57 117.38 3iuh h LYS 208 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 3iuh h LYS 208 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 3iuh h LYS 208 CO -0.08 0.12 0.00 0.41 -0.57 0.00 0.00 179.45 179.33 3iuh n GLY 209 N -0.89 0.43 3.72 3.86 0.00 -0.38 -4.89 105.19 107.03 3iuh n GLY 209 Ca -0.02 -0.32 -0.40 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.00 4.32 1.33 0.99 1.43 -0.85 -5.01 118.68 119.90 3iuh s LEU 210 Ca 0.20 1.24 -0.21 0.00 -1.03 0.00 0.00 54.13 54.33 3iuh s LEU 210 Cb 0.10 -3.14 0.33 0.00 0.03 0.00 0.00 46.19 43.52 3iuh s LEU 210 CO 0.13 -0.13 0.99 -2.84 0.23 0.00 0.00 176.35 174.73 3iuh s PRO 211 N 0.81 -2.23 0.21 1.29 0.02 -1.26 -4.89 135.00 128.95 3iuh s PRO 211 Ca 0.39 0.14 -0.07 0.00 0.02 0.00 0.00 61.00 61.49 3iuh s PRO 211 Cb -0.18 -1.46 0.17 0.00 0.02 0.00 0.00 34.50 33.05 3iuh s PRO 211 CO 0.19 -4.42 1.71 -0.44 -0.33 0.00 0.00 177.00 173.71 3iuh h ASP 212 N -3.10 0.98 -0.56 2.53 3.32 -2.00 -3.06 116.42 114.53 3iuh h ASP 212 Ca -0.46 -0.24 -0.08 0.00 0.02 0.00 0.00 57.03 56.27 3iuh h ASP 212 Cb 1.33 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 40.57 3iuh h ASP 212 CO 0.32 0.99 0.11 -0.90 -1.72 0.00 0.00 179.24 178.05 3iuh n ASP 213 N -4.21 4.79 -4.79 6.45 5.75 -1.26 -4.95 116.55 118.33 3iuh n ASP 213 Ca 0.04 -2.91 -0.25 0.00 -0.01 0.00 0.00 54.79 51.66 3iuh n ASP 213 Cb 0.30 -0.69 -0.05 0.00 -1.03 0.00 0.00 41.12 39.65 3iuh n ASP 213 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 3iuh s TRP 214 N -2.56 3.09 0.11 2.11 0.52 -1.16 -4.87 118.94 116.18 3iuh s TRP 214 Ca 0.47 -0.06 0.09 0.00 0.02 0.00 0.00 56.10 56.62 3iuh s TRP 214 Cb 0.37 -1.46 -0.04 0.00 -1.15 0.00 0.00 33.47 31.19 3iuh s TRP 214 CO 0.13 0.52 -0.22 0.15 0.02 0.00 0.00 176.95 177.55 3iuh s LYS 215 N -3.28 1.19 -0.26 4.98 1.02 -0.91 -4.83 119.74 117.66 3iuh s LYS 215 Ca 0.31 -1.22 -0.01 0.00 0.02 0.00 0.00 55.97 55.07 3iuh s LYS 215 Cb -0.09 -1.48 0.04 0.00 -0.52 0.00 0.00 37.83 35.77 3iuh s LYS 215 CO 0.23 0.34 -0.07 -1.17 -0.92 0.00 0.00 175.35 173.77 3iuh s LEU 216 N -2.01 3.29 -0.18 3.17 2.96 0.10 -1.62 118.68 124.39 3iuh s LEU 216 Ca 0.09 -1.01 -0.08 0.00 -0.22 0.00 0.00 54.13 52.90 3iuh s LEU 216 Cb -0.10 -1.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 3iuh s LEU 216 CO 0.05 -0.15 0.09 -0.36 -1.32 0.00 0.00 176.35 174.66 3iuh s PHE 217 N 1.28 3.34 -0.06 5.38 0.08 -0.09 -1.68 117.98 126.23 3iuh s PHE 217 Ca -0.02 0.21 0.01 0.00 0.12 0.00 0.00 56.93 57.25 3iuh s PHE 217 Cb -0.17 -2.09 -0.03 0.00 -0.57 0.00 0.00 43.02 40.15 3iuh s PHE 217 CO -0.04 0.26 -0.06 -1.54 -0.10 0.00 0.00 175.22 173.74 3iuh s SER 218 N 0.23 4.74 -0.14 1.36 1.04 -0.95 0.05 113.70 120.03 3iuh s SER 218 Ca 0.06 -0.02 0.02 0.00 0.48 0.00 0.00 55.95 56.49 3iuh s SER 218 Cb -0.12 -1.20 0.02 0.00 0.10 0.00 0.00 66.02 64.82 3iuh s SER 218 CO -0.00 0.35 -0.18 -0.70 0.98 0.00 0.00 173.24 173.68 3iuh s GLU 219 N -0.95 2.67 0.38 4.02 2.12 -0.88 -1.26 118.70 124.79 3iuh s GLU 219 Ca 0.14 -0.72 -0.08 0.00 0.36 0.00 0.00 54.97 54.67 3iuh s GLU 219 Cb -0.11 -2.25 -0.06 0.00 0.26 0.00 0.00 34.13 31.97 3iuh s GLU 219 CO 0.03 -0.10 0.70 -3.38 -0.54 0.00 0.00 175.26 171.97 3iuh s HIS 220 N 1.07 3.49 -0.22 5.30 -3.43 -1.26 -4.71 115.29 115.53 3iuh s HIS 220 Ca -0.03 0.87 -0.13 0.00 -0.80 0.00 0.00 55.06 54.98 3iuh s HIS 220 Cb -0.14 -2.31 0.07 0.00 -1.43 0.00 0.00 32.58 28.77 3iuh s HIS 220 CO -0.05 -0.05 0.55 0.21 -2.00 0.00 0.00 174.74 173.40 3iuh s LYS 221 N -3.91 0.56 0.16 -0.38 2.20 -0.54 -4.73 119.74 113.10 3iuh s LYS 221 Ca 0.48 0.99 -0.14 0.00 -0.36 0.00 0.00 55.97 56.94 3iuh s LYS 221 Cb -0.10 0.08 0.04 0.00 -1.51 0.00 0.00 37.83 36.34 3iuh s LYS 221 CO 0.33 -0.15 1.74 1.98 -0.36 0.00 0.00 175.35 178.89 3iuh h MET 222 N 6.90 0.71 -2.96 4.03 1.85 -1.06 -3.36 114.93 121.04 3iuh h MET 222 Ca -0.33 -0.10 0.07 0.00 -0.61 0.00 0.00 59.70 58.73 3iuh h MET 222 Cb 1.20 -0.13 -0.05 0.00 0.43 0.00 0.00 31.60 33.06 3iuh h MET 222 CO 0.22 0.59 0.25 1.52 -0.40 0.00 0.00 176.91 179.09 3iuh s TYR 223 N -5.72 -0.17 0.02 1.39 1.13 -1.26 -4.54 117.35 108.20 3iuh s TYR 223 Ca -0.13 -0.30 0.00 0.00 -1.41 0.00 0.00 57.07 55.23 3iuh s TYR 223 Cb 0.12 0.71 0.00 0.00 -1.10 0.00 0.00 41.96 41.69 3iuh s TYR 223 CO 0.76 -1.24 0.00 -1.91 -2.51 0.00 0.00 175.55 170.66 3iuh n GLU 224 N -0.47 -0.71 0.29 -3.49 2.13 -1.26 -4.83 120.64 112.30 3iuh n GLU 224 Ca -0.04 0.94 0.18 0.00 0.66 0.00 0.00 57.16 58.91 3iuh n GLU 224 Cb 0.59 -0.72 0.81 0.00 0.27 0.00 0.00 31.44 32.39 3iuh n GLU 224 CO 0.00 0.00 0.00 -1.00 -0.41 0.00 0.00 177.13 175.72 3iuh h PRO 225 N 0.56 0.00 -6.24 5.31 0.13 -1.94 -3.49 132.00 126.34 3iuh h PRO 225 Ca 0.00 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.58 3iuh h PRO 225 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 3iuh h PRO 225 CO 0.00 0.01 0.35 0.00 -0.23 0.00 0.00 178.00 178.13 3iuh s ALA 226 N -3.79 3.29 -1.05 -0.56 0.00 -1.26 -4.97 121.76 113.42 3iuh s ALA 226 Ca -0.00 0.35 0.15 0.00 0.00 0.00 0.00 51.96 52.46 3iuh s ALA 226 Cb 0.10 -3.26 0.50 0.00 0.00 0.00 0.00 23.12 20.45 3iuh s ALA 226 CO 0.52 -0.33 1.42 1.19 0.00 0.00 0.00 175.76 178.55 3iuh n PHE 227 N 4.27 0.86 0.03 0.00 3.72 -1.23 -4.57 117.46 120.54 3iuh n PHE 227 Ca 0.05 -0.58 0.00 0.00 -0.05 0.00 0.00 57.45 56.87 3iuh n PHE 227 Cb 0.50 -0.11 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 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 0.71 -0.32 -3.90 1.38 9.36 -0.59 -4.94 117.16 118.86 3iuh n TYR 228 Ca 0.19 0.06 -0.11 0.00 3.32 0.00 0.00 57.90 61.36 3iuh n TYR 228 Cb 0.64 0.19 -0.10 0.00 -0.63 0.00 0.00 39.34 39.44 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 -5.22 0.09 -0.04 2.98 1.04 -0.56 -4.99 113.70 107.00 3iuh s SER 229 Ca 0.00 -0.28 0.02 0.00 0.48 0.00 0.00 55.95 56.17 3iuh s SER 229 Cb 0.00 0.17 0.01 0.00 0.10 0.00 0.00 66.02 66.30 3iuh s SER 229 CO 0.00 -0.34 -0.10 -0.89 0.98 0.00 0.00 173.24 172.89 3iuh s THR 230 N -1.35 0.94 0.11 2.02 2.01 -1.26 -0.07 115.64 118.04 3iuh s THR 230 Ca -0.15 -0.40 -0.30 0.00 0.31 0.00 0.00 61.69 61.15 3iuh s THR 230 Cb -0.08 -0.85 -0.09 0.00 0.01 0.00 0.00 72.50 71.48 3iuh s THR 230 CO 0.01 0.30 1.60 0.58 -0.69 0.00 0.00 174.62 176.41 3iuh h VAL 231 N 5.69 0.21 -2.73 3.82 2.07 -1.71 -2.85 116.25 120.76 3iuh h VAL 231 Ca -0.33 0.00 -0.80 0.00 0.82 0.00 0.00 66.70 66.39 3iuh h VAL 231 Cb 1.17 0.21 -0.25 0.00 -1.52 0.00 0.00 31.29 30.90 3iuh h VAL 231 CO 0.48 0.00 0.97 0.52 0.02 0.00 0.00 177.57 179.56 3iuh n VAL 232 N -5.45 5.03 0.08 2.57 0.31 -1.26 -4.82 118.33 114.79 3iuh n VAL 232 Ca -0.07 -5.56 -0.11 0.00 -0.01 0.00 0.00 64.34 58.59 3iuh n VAL 232 Cb 0.36 -2.21 -0.05 0.00 -0.91 0.00 0.00 33.84 31.03 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 5.72 0.23 0.00 5.55 -0.00 -1.64 -1.43 115.11 123.53 3iuh h GLN 233 Ca 0.23 -0.29 -0.31 0.00 -0.00 0.00 0.00 58.65 58.29 3iuh h GLN 233 Cb 0.66 0.09 -0.08 0.00 -0.00 0.00 0.00 27.48 28.16 3iuh h GLN 233 CO 1.34 1.04 -0.19 -0.40 -0.00 0.00 0.00 178.83 180.61 3iuh n ASP 234 N -3.62 -1.30 0.27 0.06 5.68 -1.26 -2.30 116.55 114.08 3iuh n ASP 234 Ca -0.05 -2.97 0.14 0.00 -0.50 0.00 0.00 54.79 51.41 3iuh n ASP 234 Cb 0.87 2.48 0.75 0.00 -1.14 0.00 0.00 41.12 44.08 3iuh n ASP 234 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 3iuh h TRP 235 N 2.04 0.00 -0.02 2.11 5.08 -1.94 -0.76 115.95 122.46 3iuh h TRP 235 Ca -0.27 0.00 -0.00 0.00 1.08 0.00 0.00 58.89 59.70 3iuh h TRP 235 Cb 1.21 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.37 3iuh h TRP 235 CO 0.00 0.10 0.00 0.78 -1.28 0.00 0.00 178.44 178.04 3iuh h GLY 236 N 0.99 0.04 1.05 11.11 0.00 -1.99 0.25 103.07 114.52 3iuh h GLY 236 Ca -0.00 -0.03 -0.08 0.00 0.00 0.00 0.00 47.33 47.22 3iuh h GLY 236 CO 0.01 0.03 0.09 -0.84 0.00 0.00 0.00 176.54 175.83 3iuh h THR 237 N -0.24 1.26 -0.41 4.70 2.02 -1.85 -2.48 112.91 115.91 3iuh h THR 237 Ca 0.01 -1.03 0.02 0.00 0.77 0.00 0.00 66.41 66.18 3iuh h THR 237 Cb 0.30 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 3iuh h THR 237 CO 0.00 0.38 0.23 -1.13 0.37 0.00 0.00 175.52 175.37 3iuh h ASN 238 N 0.93 0.37 -0.66 4.18 -0.73 -0.96 -1.17 115.58 117.54 3iuh h ASN 238 Ca 0.18 0.01 0.03 0.00 1.87 0.00 0.00 56.30 58.39 3iuh h ASN 238 Cb 0.45 -0.07 -0.04 0.00 0.27 0.00 0.00 38.32 38.93 3iuh h ASN 238 CO 0.01 0.26 0.41 0.22 -0.37 0.00 0.00 177.43 177.96 3iuh h TYR 239 N 0.47 0.76 -0.49 0.67 3.20 -0.33 -0.96 116.97 120.28 3iuh h TYR 239 Ca 0.17 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.10 3iuh h TYR 239 Cb 0.03 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.03 3iuh h TYR 239 CO -0.08 0.43 0.32 -0.07 -1.64 0.00 0.00 178.16 177.12 3iuh h LEU 240 N 0.79 0.45 0.44 2.82 3.38 -0.90 -0.07 115.31 122.22 3iuh h LEU 240 Ca 0.27 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.21 3iuh h LEU 240 Cb 0.03 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3iuh h LEU 240 CO -0.11 0.31 -0.21 0.40 0.09 0.00 0.00 178.44 178.92 3iuh h ILE 241 N 0.53 0.33 -0.15 1.22 2.04 -0.02 -2.23 117.51 119.24 3iuh h ILE 241 Ca 0.20 -0.57 0.04 0.00 1.00 0.00 0.00 64.86 65.52 3iuh h ILE 241 Cb 0.14 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 3iuh h ILE 241 CO -0.05 0.06 -0.08 0.00 0.00 0.00 0.00 178.15 178.09 3iuh h ALA 242 N -0.77 0.05 -0.76 1.87 0.00 -1.05 0.46 119.26 119.06 3iuh h ALA 242 Ca -0.06 0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.98 3iuh h ALA 242 Cb 0.56 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 3iuh h ALA 242 CO 0.10 -0.52 0.44 0.37 0.00 0.00 0.00 179.25 179.63 3iuh h GLN 243 N -0.07 0.76 -0.60 0.00 5.75 -1.11 -2.19 115.11 117.66 3iuh h GLN 243 Ca 0.08 -0.05 -0.10 0.00 -0.15 0.00 0.00 58.65 58.44 3iuh h GLN 243 Cb 0.19 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.55 3iuh h GLN 243 CO -0.19 0.50 -0.01 1.15 -2.65 0.00 0.00 178.83 177.63 3iuh h THR 244 N 0.78 1.27 -0.24 2.39 2.02 -0.73 -3.30 112.91 115.09 3iuh h THR 244 Ca 0.34 -1.17 -0.15 0.00 0.77 0.00 0.00 66.41 66.21 3iuh h THR 244 Cb 0.23 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 67.46 3iuh h THR 244 CO -0.20 0.42 -0.42 -0.07 0.37 0.00 0.00 175.52 175.63 3iuh h LEU 245 N 0.97 0.79 0.00 2.58 3.38 -0.43 -3.50 115.31 119.09 3iuh h LEU 245 Ca 0.17 -0.53 0.00 0.00 0.09 0.00 0.00 57.88 57.61 3iuh h LEU 245 Cb 0.57 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3iuh h LEU 245 CO 0.03 1.17 0.00 0.61 0.09 0.00 0.00 178.44 180.34 3iuh n GLY 246 N 0.35 1.62 0.46 0.83 0.00 -0.87 -4.90 105.19 102.68 3iuh n GLY 246 Ca -0.05 -1.95 0.27 0.00 0.00 0.00 0.00 46.02 44.29 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 0.12 -0.00 1.61 0.11 -1.90 -1.35 132.00 130.59 3iuh h PRO 247 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3iuh h PRO 247 Cb 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.08 3iuh h PRO 247 CO 0.00 0.08 -0.16 1.63 -0.21 0.00 0.00 178.00 179.34 3iuh n LYS 248 N -4.35 0.31 -3.78 1.05 5.02 -1.26 -4.81 118.16 110.34 3iuh n LYS 248 Ca 0.20 -0.10 -0.35 0.00 -2.02 0.00 0.00 58.31 56.04 3iuh n LYS 248 Cb 0.94 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 34.36 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 -2.76 3.57 0.34 7.82 0.00 -0.51 -0.72 121.76 129.50 3iuh s ALA 249 Ca 0.20 -0.79 0.04 0.00 0.00 0.00 0.00 51.96 51.42 3iuh s ALA 249 Cb 0.19 -2.15 -0.03 0.00 0.00 0.00 0.00 23.12 21.13 3iuh s ALA 249 CO 0.54 0.02 0.17 -0.65 0.00 0.00 0.00 175.76 175.84 3iuh s GLN 250 N 0.64 1.73 0.01 0.00 -0.21 -0.68 -4.69 119.66 116.46 3iuh s GLN 250 Ca 0.06 -2.01 0.03 0.00 0.02 0.00 0.00 55.36 53.46 3iuh s GLN 250 Cb -0.12 -0.21 -0.03 0.00 1.00 0.00 0.00 33.01 33.65 3iuh s GLN 250 CO 0.01 -0.49 -0.05 0.00 -2.12 0.00 0.00 175.29 172.65 3iuh s LEU 252 N -1.54 3.74 -0.34 0.00 1.43 -0.39 -0.03 118.68 121.54 3iuh s LEU 252 Ca 0.18 0.13 -0.06 0.00 -1.03 0.00 0.00 54.13 53.35 3iuh s LEU 252 Cb -0.11 -1.91 0.04 0.00 0.03 0.00 0.00 46.19 44.24 3iuh s LEU 252 CO 0.09 0.28 0.10 -0.69 0.23 0.00 0.00 176.35 176.36 3iuh s VAL 253 N -0.25 3.76 -0.33 -1.59 1.01 -0.65 -4.11 120.40 118.25 3iuh s VAL 253 Ca 0.07 -1.13 -0.14 0.00 0.00 0.00 0.00 61.98 60.78 3iuh s VAL 253 Cb -0.12 -3.13 -0.02 0.00 0.00 0.00 0.00 36.38 33.11 3iuh s VAL 253 CO 0.02 -0.17 0.33 -0.62 0.00 0.00 0.00 175.10 174.65 3iuh s ASP 254 N 1.40 6.15 0.23 3.32 -1.08 -1.26 -0.22 116.67 125.21 3iuh s ASP 254 Ca -0.02 -0.17 -0.18 0.00 -0.52 0.00 0.00 52.55 51.67 3iuh s ASP 254 Cb -0.19 -2.18 0.23 0.00 -1.46 0.00 0.00 42.92 39.32 3iuh s ASP 254 CO 0.03 -0.27 1.53 -0.11 0.52 0.00 0.00 175.17 176.87 3iuh n LEU 255 N 5.30 -0.65 -0.04 -1.34 -0.00 -0.99 -1.14 117.00 118.13 3iuh n LEU 255 Ca -0.10 1.73 0.00 0.00 -0.00 0.00 0.00 56.01 57.64 3iuh n LEU 255 Cb 0.50 -0.39 0.00 0.00 -0.00 0.00 0.00 43.42 43.53 3iuh n LEU 255 CO 0.38 -1.55 0.49 0.61 -0.00 0.00 0.00 177.39 177.32 3iuh n GLY 256 N -1.46 -0.81 2.07 -3.96 0.00 -1.26 -4.04 105.19 95.73 3iuh n GLY 256 Ca 0.10 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.45 2.66 -4.43 1.61 8.25 -0.29 -3.13 115.22 119.44 3iuh n HIS 257 Ca 0.00 -1.48 -0.22 0.00 -0.26 0.00 0.00 57.72 55.76 3iuh n HIS 257 Cb 0.02 -0.80 -0.10 0.00 1.12 0.00 0.00 29.99 30.23 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 -3.00 2.10 0.71 4.41 3.76 -1.26 -2.34 115.29 119.67 3iuh s HIS 258 Ca 0.53 -0.44 -0.15 0.00 -0.15 0.00 0.00 55.06 54.85 3iuh s HIS 258 Cb 0.44 -0.96 0.03 0.00 1.11 0.00 0.00 32.58 33.19 3iuh s HIS 258 CO 0.12 0.58 1.21 0.00 -0.85 0.00 0.00 174.74 175.79 3iuh s ALA 259 N -2.69 2.18 0.40 -1.40 0.00 -1.26 -4.91 121.76 114.08 3iuh s ALA 259 Ca 0.28 0.89 -0.25 0.00 0.00 0.00 0.00 51.96 52.87 3iuh s ALA 259 Cb -0.03 -3.46 -0.11 0.00 0.00 0.00 0.00 23.12 19.52 3iuh s ALA 259 CO 0.12 -1.77 1.12 -2.30 0.00 0.00 0.00 175.76 172.93 3iuh n PRO 260 N -2.57 1.61 -0.78 0.00 -0.02 -1.26 -2.03 135.00 129.95 3iuh n PRO 260 Ca 0.13 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3iuh n PRO 260 Cb 0.50 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 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 0.53 -1.46 -4.67 2.55 3.02 -1.26 -4.98 115.26 108.99 3iuh n ASN 261 Ca 0.08 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.23 3iuh n ASN 261 Cb 0.38 -1.83 0.03 0.00 -0.61 0.00 0.00 39.78 37.75 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 -2.11 3.03 -3.08 3.41 -1.04 -0.86 -4.91 114.28 108.72 3iuh n THR 262 Ca 0.00 -0.50 -0.45 0.00 -2.04 0.00 0.00 64.05 61.06 3iuh n THR 262 Cb 0.09 -1.42 -0.04 0.00 -1.82 0.00 0.00 70.33 67.15 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 -0.80 6.37 0.11 8.00 3.84 -1.26 -4.89 114.94 126.30 3iuh s ASN 263 Ca 0.67 -1.72 -0.14 0.00 0.21 0.00 0.00 52.86 51.87 3iuh s ASN 263 Cb -0.48 -2.32 -0.08 0.00 -0.55 0.00 0.00 41.25 37.82 3iuh s ASN 263 CO 0.54 -1.05 1.44 0.40 -2.79 0.00 0.00 177.10 175.63 3iuh h ILE 264 N 5.74 1.30 -0.44 -5.21 2.04 -1.97 -3.06 117.51 115.90 3iuh h ILE 264 Ca -0.13 -1.43 0.09 0.00 1.00 0.00 0.00 64.86 64.38 3iuh h ILE 264 Cb 1.06 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 38.65 3iuh h ILE 264 CO 1.06 0.46 0.31 1.05 0.00 0.00 0.00 178.15 181.02 3iuh h GLU 265 N 0.48 0.18 -0.31 2.37 9.09 -1.90 -0.81 114.58 123.68 3iuh h GLU 265 Ca 0.05 -0.01 -0.11 0.00 0.05 0.00 0.00 59.36 59.34 3iuh h GLU 265 Cb 0.84 -0.04 -0.01 0.00 -1.65 0.00 0.00 28.75 27.89 3iuh h GLU 265 CO 0.07 0.12 -0.25 1.98 0.05 0.00 0.00 179.01 180.99 3iuh h MET 266 N 0.19 0.72 -0.79 1.06 4.05 -1.93 -1.80 114.93 116.43 3iuh h MET 266 Ca 0.20 -0.36 0.05 0.00 -0.28 0.00 0.00 59.70 59.32 3iuh h MET 266 Cb 0.56 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.31 3iuh h MET 266 CO -0.03 0.97 0.49 0.82 0.23 0.00 0.00 176.91 179.39 3iuh h ILE 267 N 0.48 1.06 -0.52 1.77 2.04 -1.14 0.52 117.51 121.71 3iuh h ILE 267 Ca 0.06 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.63 3iuh h ILE 267 Cb 0.81 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 3iuh h ILE 267 CO 0.06 0.17 0.31 0.58 0.00 0.00 0.00 178.15 179.27 3iuh h VAL 268 N 0.92 1.05 -0.50 1.67 2.07 -1.09 -1.53 116.25 118.84 3iuh h VAL 268 Ca 0.34 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.61 3iuh h VAL 268 Cb 0.12 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 3iuh h VAL 268 CO -0.15 0.11 0.15 0.00 0.02 0.00 0.00 177.57 177.70 3iuh h ALA 269 N 1.23 0.65 -0.43 1.67 0.00 -0.40 -2.20 119.26 119.79 3iuh h ALA 269 Ca 0.21 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3iuh h ALA 269 Cb 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3iuh h ALA 269 CO -0.09 0.31 0.23 0.00 0.00 0.00 0.00 179.25 179.70 3iuh h ARG 270 N 0.67 0.60 -0.51 0.00 2.47 -0.63 -0.58 114.38 116.40 3iuh h ARG 270 Ca 0.16 -0.07 -0.02 0.00 -1.26 0.00 0.00 59.98 58.79 3iuh h ARG 270 Cb 0.28 -0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.46 3iuh h ARG 270 CO -0.00 0.48 0.24 -0.07 0.56 0.00 0.00 179.97 181.18 3iuh h LEU 271 N 0.56 0.67 -0.45 3.04 3.38 -1.21 -2.07 115.31 119.23 3iuh h LEU 271 Ca 0.15 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3iuh h LEU 271 Cb 0.06 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 3iuh h LEU 271 CO -0.02 0.62 0.28 0.40 0.09 0.00 0.00 178.44 179.80 3iuh h ILE 272 N 0.68 1.14 -0.91 1.22 2.04 -1.21 0.77 117.51 121.23 3iuh h ILE 272 Ca 0.17 -0.30 0.10 0.00 1.00 0.00 0.00 64.86 65.83 3iuh h ILE 272 Cb 0.13 0.52 -0.08 0.00 -0.74 0.00 0.00 36.82 36.66 3iuh h ILE 272 CO -0.02 0.14 0.55 -0.61 0.00 0.00 0.00 178.15 178.21 3iuh h GLN 273 N 0.60 0.88 -0.65 2.37 4.15 -0.76 -1.33 115.11 120.38 3iuh h GLN 273 Ca 0.16 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.53 3iuh h GLN 273 Cb -0.02 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.47 3iuh h GLN 273 CO -0.03 0.58 0.00 1.19 -1.93 0.00 0.00 178.83 178.64 3iuh n PHE 274 N -4.67 1.66 -2.55 3.99 3.72 -0.81 -4.94 117.46 113.86 3iuh n PHE 274 Ca 0.16 -0.58 -0.18 0.00 -0.05 0.00 0.00 57.45 56.79 3iuh n PHE 274 Cb 0.30 -0.41 -0.00 0.00 -0.94 0.00 0.00 39.48 38.42 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 0.59 -0.50 0.22 1.37 0.00 -0.50 -4.90 105.19 101.47 3iuh n GLY 275 Ca 0.23 0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.36 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 -3.11 1.23 -3.02 1.61 4.76 0.16 -4.89 118.16 114.89 3iuh n LYS 276 Ca -0.18 -2.59 -0.44 0.00 -2.87 0.00 0.00 58.31 52.22 3iuh n LYS 276 Cb 0.64 -1.43 -0.04 0.00 -1.84 0.00 0.00 35.03 32.37 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 -2.70 5.08 0.18 -0.35 2.96 -1.22 -0.33 118.68 122.30 3iuh s LEU 277 Ca 0.31 -1.39 0.02 0.00 -0.22 0.00 0.00 54.13 52.84 3iuh s LEU 277 Cb 0.28 -2.35 0.04 0.00 0.50 0.00 0.00 46.19 44.67 3iuh s LEU 277 CO 0.01 -1.20 1.41 1.23 -1.32 0.00 0.00 176.35 176.48 3iuh h GLY 278 N 10.39 0.27 0.00 7.98 0.00 -0.74 -3.41 103.07 117.56 3iuh h GLY 278 Ca -0.23 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.67 3iuh h GLY 278 CO 1.12 0.38 0.00 0.61 0.00 0.00 0.00 176.54 178.65 3iuh n GLY 279 N 0.73 0.83 3.24 4.60 0.00 -1.20 -0.14 105.19 113.24 3iuh n GLY 279 Ca -0.04 -0.87 -0.32 0.00 0.00 0.00 0.00 46.02 44.80 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 2.47 -0.33 1.61 2.19 -1.26 -1.64 117.98 119.03 3iuh s PHE 280 Ca 0.00 -0.87 -0.11 0.00 0.33 0.00 0.00 56.93 56.28 3iuh s PHE 280 Cb 0.00 -1.64 -0.01 0.00 -1.31 0.00 0.00 43.02 40.06 3iuh s PHE 280 CO 0.00 -0.31 0.19 -1.01 1.83 0.00 0.00 175.22 175.92 3iuh s HIS 281 N 0.09 3.20 0.18 10.12 3.76 0.69 -2.34 115.29 130.99 3iuh s HIS 281 Ca -0.11 -0.44 -0.24 0.00 -0.15 0.00 0.00 55.06 54.12 3iuh s HIS 281 Cb -0.16 -2.41 -0.08 0.00 1.11 0.00 0.00 32.58 31.04 3iuh s HIS 281 CO 0.06 -0.42 0.77 -0.06 -0.85 0.00 0.00 174.74 174.23 3iuh s PHE 282 N 1.66 3.83 0.00 1.40 0.08 0.21 -2.34 117.98 122.82 3iuh s PHE 282 Ca 0.05 1.58 0.00 0.00 0.12 0.00 0.00 56.93 58.68 3iuh s PHE 282 Cb -0.17 -2.73 0.00 0.00 -0.57 0.00 0.00 43.02 39.54 3iuh s PHE 282 CO 0.08 0.46 0.00 0.27 -0.10 0.00 0.00 175.22 175.93 3iuh n ASN 283 N 1.34 0.00 -4.39 1.36 0.23 -1.26 -1.33 115.26 111.21 3iuh n ASN 283 Ca -0.05 0.00 -0.19 0.00 -0.53 0.00 0.00 54.58 53.81 3iuh n ASN 283 Cb 0.49 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.09 3iuh n ASN 283 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3iuh s ASP 284 N 0.00 1.98 0.16 0.53 -1.08 0.17 -4.62 116.67 113.81 3iuh s ASP 284 Ca 0.00 -1.33 -0.24 0.00 -0.52 0.00 0.00 52.55 50.46 3iuh s ASP 284 Cb 0.00 -0.01 0.06 0.00 -1.46 0.00 0.00 42.92 41.52 3iuh s ASP 284 CO 0.00 -0.60 0.72 -0.94 0.52 0.00 0.00 175.17 174.87 3iuh s SER 285 N -3.40 -0.42 0.00 -0.34 1.04 -1.26 -1.63 113.70 107.69 3iuh s SER 285 Ca 0.34 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.59 3iuh s SER 285 Cb 0.08 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.78 3iuh s SER 285 CO 0.13 -0.99 0.00 1.17 0.98 0.00 0.00 173.24 174.53 3iuh n LYS 286 N -0.38 1.34 -0.05 4.02 4.81 -1.26 -4.75 118.16 121.89 3iuh n LYS 286 Ca -0.11 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.25 3iuh n LYS 286 Cb 0.63 -0.73 -0.04 0.00 0.02 0.00 0.00 35.03 34.91 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 -1.38 0.00 0.00 5.64 4.01 -1.26 -5.09 117.16 119.08 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 0.23 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 38.92 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 2.78 3.33 2.98 2.72 0.00 -1.26 -4.90 105.19 110.84 3iuh n GLY 288 Ca -0.17 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.34 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 5.53 0.12 1.61 2.03 -1.18 -4.74 116.55 119.92 3iuh n ASP 289 Ca 0.00 -3.19 0.12 0.00 0.52 0.00 0.00 54.79 52.24 3iuh n ASP 289 Cb 0.00 -1.42 0.46 0.00 -0.72 0.00 0.00 41.12 39.44 3iuh n ASP 289 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3iuh n ASP 290 N 3.17 0.74 -4.17 1.67 8.00 -1.26 -4.92 116.55 119.78 3iuh n ASP 290 Ca 0.35 0.63 -0.34 0.00 0.71 0.00 0.00 54.79 56.13 3iuh n ASP 290 Cb 0.36 -0.81 -0.03 0.00 -0.02 0.00 0.00 41.12 40.63 3iuh n ASP 290 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3iuh n ASP 291 N -2.26 -2.72 -4.91 -2.24 8.00 -1.24 -4.75 116.55 106.43 3iuh n ASP 291 Ca 0.04 -1.01 -0.28 0.00 0.71 0.00 0.00 54.79 54.24 3iuh n ASP 291 Cb 0.32 -2.81 0.06 0.00 -0.02 0.00 0.00 41.12 38.66 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 -7.22 2.89 0.05 0.64 1.43 -0.65 -0.88 118.68 114.94 3iuh s LEU 292 Ca 0.59 0.80 -0.35 0.00 -1.03 0.00 0.00 54.13 54.15 3iuh s LEU 292 Cb -0.32 -3.52 -0.14 0.00 0.03 0.00 0.00 46.19 42.24 3iuh s LEU 292 CO 0.92 -1.44 1.61 0.47 0.23 0.00 0.00 176.35 178.14 3iuh n ASP 293 N -2.94 2.81 -4.58 2.29 9.92 -1.26 -0.65 116.55 122.13 3iuh n ASP 293 Ca 0.07 1.06 -0.51 0.00 -0.53 0.00 0.00 54.79 54.88 3iuh n ASP 293 Cb 0.59 -1.34 -0.05 0.00 -0.64 0.00 0.00 41.12 39.67 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 4.13 -0.98 -0.76 2.24 0.00 -1.26 -1.23 120.51 122.65 3iuh n ALA 294 Ca 0.19 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.13 3iuh n ALA 294 Cb 0.25 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.65 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 2.33 0.58 0.24 0.00 0.00 -1.26 -4.75 105.19 102.33 3iuh n GLY 295 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 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 1.02 0.00 4.61 0.00 -1.53 -3.28 119.26 120.08 3iuh h ALA 296 Ca 0.00 -0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 3iuh h ALA 296 Cb 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3iuh h ALA 296 CO 0.00 0.18 -1.61 -0.89 0.00 0.00 0.00 179.25 176.93 3iuh n ILE 297 N -3.29 0.67 -3.46 0.00 2.08 -1.26 -4.91 119.36 109.20 3iuh n ILE 297 Ca 0.00 -0.15 -0.26 0.00 0.56 0.00 0.00 62.75 62.90 3iuh n ILE 297 Cb 0.39 -1.67 -0.09 0.00 -0.75 0.00 0.00 39.64 37.52 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 -3.54 1.49 0.19 0.38 1.02 -1.26 -4.96 120.64 113.96 3iuh n GLU 298 Ca -0.22 -3.99 0.08 0.00 -0.02 0.00 0.00 57.16 53.00 3iuh n GLU 298 Cb 0.65 -1.89 0.59 0.00 -0.02 0.00 0.00 31.44 30.77 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 4.64 0.12 -0.48 3.49 0.13 -1.91 -2.48 132.00 135.52 3iuh h PRO 299 Ca 0.17 -0.01 -0.09 0.00 -0.87 0.00 0.00 66.00 65.20 3iuh h PRO 299 Cb 0.78 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.87 3iuh h PRO 299 CO 0.63 0.08 -0.06 -0.92 -0.23 0.00 0.00 178.00 177.51 3iuh h TYR 300 N 0.13 0.98 -0.79 1.56 3.20 -1.92 -1.67 116.97 118.45 3iuh h TYR 300 Ca 0.05 -0.19 0.02 0.00 3.14 0.00 0.00 58.73 61.74 3iuh h TYR 300 Cb 0.04 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.02 3iuh h TYR 300 CO -0.00 0.94 0.52 -0.09 -1.64 0.00 0.00 178.16 177.90 3iuh h ARG 301 N 0.74 1.01 -0.65 1.82 2.43 -1.88 0.15 114.38 118.00 3iuh h ARG 301 Ca 0.13 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 3iuh h ARG 301 Cb 0.59 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 3iuh h ARG 301 CO 0.04 0.67 0.25 1.25 -1.51 0.00 0.00 179.97 180.67 3iuh h LEU 302 N 1.04 0.91 -0.59 3.80 5.85 -1.20 -0.85 115.31 124.27 3iuh h LEU 302 Ca 0.30 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 3iuh h LEU 302 Cb -0.07 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.70 3iuh h LEU 302 CO -0.07 0.84 0.06 0.15 -0.34 0.00 0.00 178.44 179.08 3iuh h PHE 303 N 0.93 1.08 -0.18 1.25 3.57 -0.32 -1.64 116.94 121.62 3iuh h PHE 303 Ca 0.22 -0.16 -0.06 0.00 3.53 0.00 0.00 57.97 61.49 3iuh h PHE 303 Cb 0.22 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 3iuh h PHE 303 CO 0.01 0.94 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.81 3iuh h LEU 304 N 0.90 0.29 -0.29 0.59 3.38 -0.26 0.27 115.31 120.19 3iuh h LEU 304 Ca 0.18 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 3iuh h LEU 304 Cb 0.47 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3iuh h LEU 304 CO 0.02 0.47 -0.14 0.58 0.09 0.00 0.00 178.44 179.45 3iuh h VAL 305 N 0.28 1.30 0.00 1.22 2.07 -0.87 -2.86 116.25 117.39 3iuh h VAL 305 Ca 0.05 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 3iuh h VAL 305 Cb 0.44 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3iuh h VAL 305 CO 0.03 0.40 -0.09 -0.26 0.02 0.00 0.00 177.57 177.66 3iuh h PHE 306 N 0.35 0.00 -0.40 1.57 0.04 -0.51 -1.94 116.94 116.05 3iuh h PHE 306 Ca 0.06 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.73 3iuh h PHE 306 Cb 0.67 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.80 3iuh h PHE 306 CO 0.06 0.09 -0.17 -0.97 -0.60 0.00 0.00 178.31 176.72 3iuh h ASN 307 N 0.00 0.75 -0.09 2.17 -1.24 -0.26 0.30 115.58 117.20 3iuh h ASN 307 Ca -0.00 -0.24 -0.18 0.00 0.71 0.00 0.00 56.30 56.58 3iuh h ASN 307 Cb 0.48 -0.20 -0.00 0.00 0.73 0.00 0.00 38.32 39.33 3iuh h ASN 307 CO 0.01 0.92 -0.60 -0.33 -1.29 0.00 0.00 177.43 176.15 3iuh h GLU 308 N 0.67 0.70 -0.25 6.67 4.39 -1.28 -2.12 114.58 123.35 3iuh h GLU 308 Ca 0.10 -0.47 -0.11 0.00 0.34 0.00 0.00 59.36 59.22 3iuh h GLU 308 Cb 0.66 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.37 3iuh h GLU 308 CO 0.05 1.09 -0.28 -0.07 -1.16 0.00 0.00 179.01 178.63 3iuh h LEU 309 N 0.52 0.68 -0.77 1.33 3.38 -1.07 -2.47 115.31 116.91 3iuh h LEU 309 Ca -0.00 -0.49 -0.08 0.00 0.09 0.00 0.00 57.88 57.40 3iuh h LEU 309 Cb 1.18 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 3iuh h LEU 309 CO 0.12 1.03 0.04 0.58 0.09 0.00 0.00 178.44 180.31 3iuh h VAL 310 N 0.35 1.26 -0.47 1.22 2.07 -0.45 0.84 116.25 121.07 3iuh h VAL 310 Ca 0.04 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.50 3iuh h VAL 310 Cb 0.85 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 3iuh h VAL 310 CO 0.07 0.38 0.28 -0.78 0.02 0.00 0.00 177.57 177.54 3iuh h ASP 311 N 0.91 0.56 -0.19 0.57 1.82 -1.35 -0.05 116.42 118.70 3iuh h ASP 311 Ca 0.17 -0.06 -0.10 0.00 -0.39 0.00 0.00 57.03 56.65 3iuh h ASP 311 Cb 0.47 -0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.32 3iuh h ASP 311 CO 0.02 0.46 -0.22 0.00 -1.61 0.00 0.00 179.24 177.89 3iuh h ALA 312 N 1.13 1.00 -0.58 -0.78 0.00 -1.08 -2.70 119.26 116.25 3iuh h ALA 312 Ca 0.17 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 3iuh h ALA 312 Cb -0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3iuh h ALA 312 CO -0.03 0.59 -0.05 1.49 0.00 0.00 0.00 179.25 181.25 3iuh h GLU 313 N 0.56 1.06 -0.01 0.00 4.81 -0.34 -2.11 114.58 118.54 3iuh h GLU 313 Ca 0.08 -0.37 -0.00 0.00 -0.13 0.00 0.00 59.36 58.95 3iuh h GLU 313 Cb 0.68 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 3iuh h GLU 313 CO 0.05 1.06 0.00 0.00 -0.73 0.00 0.00 179.01 179.40 3iuh h ALA 314 N 0.96 0.02 -0.80 2.92 0.00 -0.92 -3.09 119.26 118.34 3iuh h ALA 314 Ca 0.16 -0.11 -0.58 0.00 0.00 0.00 0.00 54.91 54.38 3iuh h ALA 314 Cb 0.62 -0.00 -0.23 0.00 0.00 0.00 0.00 17.79 18.17 3iuh h ALA 314 CO 0.04 -0.37 0.73 2.89 0.00 0.00 0.00 179.25 182.54 3iuh n ARG 315 N -4.97 2.44 0.00 0.00 1.85 -1.03 -4.99 116.66 109.95 3iuh n ARG 315 Ca -0.07 -2.77 0.00 0.00 -1.00 0.00 0.00 57.85 54.01 3iuh n ARG 315 Cb 0.13 -2.10 0.00 0.00 -1.05 0.00 0.00 32.46 29.44 3iuh n ARG 315 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3iuh n GLY 316 N -0.27 0.00 3.86 2.89 0.00 -0.80 -4.85 105.19 106.02 3iuh n GLY 316 Ca 0.51 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.17 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 0.00 5.18 0.01 1.61 1.01 -1.19 -5.03 120.40 121.99 3iuh s VAL 317 Ca 0.00 0.50 -0.36 0.00 0.00 0.00 0.00 61.98 62.12 3iuh s VAL 317 Cb 0.00 -3.61 -0.15 0.00 0.00 0.00 0.00 36.38 32.62 3iuh s VAL 317 CO 0.00 0.47 1.57 1.17 0.00 0.00 0.00 175.10 178.31 3iuh n LYS 318 N 1.47 1.58 -1.00 2.72 4.81 -1.26 -0.90 118.16 125.58 3iuh n LYS 318 Ca -0.13 0.57 -0.00 0.00 -0.87 0.00 0.00 58.31 57.89 3iuh n LYS 318 Cb 0.53 -2.29 -0.00 0.00 0.02 0.00 0.00 35.03 33.29 3iuh n LYS 318 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3iuh n GLY 319 N 3.39 0.47 3.27 3.14 0.00 -1.26 -4.55 105.19 109.66 3iuh n GLY 319 Ca 0.20 -0.08 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.95 3.44 -0.43 1.61 5.36 -0.08 -4.71 117.98 121.22 3iuh s PHE 320 Ca 0.00 -1.72 0.08 0.00 -0.96 0.00 0.00 56.93 54.33 3iuh s PHE 320 Cb 0.00 -3.68 0.31 0.00 -0.34 0.00 0.00 43.02 39.31 3iuh s PHE 320 CO 0.00 -0.99 0.92 0.72 -1.46 0.00 0.00 175.22 174.41 3iuh n HIS 321 N 4.72 -1.79 -1.54 10.12 8.25 -1.26 -4.77 115.22 128.94 3iuh n HIS 321 Ca -0.04 -2.72 -0.42 0.00 -0.26 0.00 0.00 57.72 54.28 3iuh n HIS 321 Cb 0.42 0.83 0.00 0.00 1.12 0.00 0.00 29.99 32.36 3iuh n HIS 321 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3iuh n PRO 322 N 0.59 1.02 -3.74 -0.41 -0.02 -1.26 -4.94 135.00 126.24 3iuh n PRO 322 Ca 0.14 0.37 -0.34 0.00 -2.02 0.00 0.00 63.50 61.64 3iuh n PRO 322 Cb 0.66 -1.79 -0.09 0.00 -0.02 0.00 0.00 33.50 32.27 3iuh n PRO 322 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3iuh s ALA 323 N -1.30 3.98 0.49 3.55 0.00 0.80 -4.93 121.76 124.35 3iuh s ALA 323 Ca 0.63 -3.72 -0.20 0.00 0.00 0.00 0.00 51.96 48.66 3iuh s ALA 323 Cb -0.61 -2.59 -0.08 0.00 0.00 0.00 0.00 23.12 19.84 3iuh s ALA 323 CO 0.57 -2.12 1.04 -1.01 0.00 0.00 0.00 175.76 174.24 3iuh s HIS 324 N -1.13 3.00 -0.05 0.00 3.76 -1.26 -4.24 115.29 115.38 3iuh s HIS 324 Ca 0.25 1.57 -0.24 0.00 -0.15 0.00 0.00 55.06 56.49 3iuh s HIS 324 Cb -0.10 -3.06 0.05 0.00 1.11 0.00 0.00 32.58 30.58 3iuh s HIS 324 CO -0.11 -0.84 0.52 1.41 -0.85 0.00 0.00 174.74 174.87 3iuh s MET 325 N -3.27 0.88 -0.03 1.40 1.75 -0.99 -1.93 119.30 117.11 3iuh s MET 325 Ca 0.67 0.11 -0.18 0.00 -1.25 0.00 0.00 55.69 55.04 3iuh s MET 325 Cb -0.16 0.41 -0.05 0.00 2.84 0.00 0.00 34.83 37.86 3iuh s MET 325 CO 0.21 -0.26 0.52 0.42 -0.65 0.00 0.00 175.02 175.26 3iuh s ILE 326 N -1.16 5.01 -0.34 10.11 1.01 -0.66 -0.62 121.20 134.56 3iuh s ILE 326 Ca -0.11 1.07 -0.01 0.00 0.00 0.00 0.00 60.65 61.59 3iuh s ILE 326 Cb -0.02 -3.85 0.12 0.00 0.01 0.00 0.00 42.46 38.72 3iuh s ILE 326 CO 0.07 0.43 0.16 -0.62 0.00 0.00 0.00 174.94 174.99 3iuh s ASP 327 N -0.20 3.50 0.21 3.58 -1.08 -0.44 -3.85 116.67 118.39 3iuh s ASP 327 Ca 0.28 -1.87 0.01 0.00 -0.52 0.00 0.00 52.55 50.45 3iuh s ASP 327 Cb -0.17 -0.60 -0.05 0.00 -1.46 0.00 0.00 42.92 40.64 3iuh s ASP 327 CO 0.14 -0.37 0.06 -1.10 0.52 0.00 0.00 175.17 174.43 3iuh s GLN 328 N 1.38 1.24 -0.10 4.34 -0.21 -1.26 -4.58 119.66 120.47 3iuh s GLN 328 Ca 0.13 -1.64 0.02 0.00 0.02 0.00 0.00 55.36 53.90 3iuh s GLN 328 Cb -0.20 -0.18 0.01 0.00 1.00 0.00 0.00 33.01 33.64 3iuh s GLN 328 CO -0.16 -0.24 -0.17 0.45 -2.12 0.00 0.00 175.29 173.05 3iuh s SER 329 N -3.22 2.46 -0.61 5.90 0.15 -0.06 -4.74 113.70 113.58 3iuh s SER 329 Ca 0.31 -0.44 -0.04 0.00 0.70 0.00 0.00 55.95 56.49 3iuh s SER 329 Cb 0.07 -1.12 0.16 0.00 -1.71 0.00 0.00 66.02 63.42 3iuh s SER 329 CO 0.09 0.06 0.43 -1.00 1.20 0.00 0.00 173.24 174.02 3iuh s HIS 330 N 0.73 3.46 -0.14 3.44 0.09 -1.26 -4.63 115.29 116.97 3iuh s HIS 330 Ca -0.12 -2.58 0.16 0.00 -0.00 0.00 0.00 55.06 52.52 3iuh s HIS 330 Cb -0.16 -3.26 -0.05 0.00 -0.00 0.00 0.00 32.58 29.11 3iuh s HIS 330 CO 0.02 -0.88 1.09 -0.91 -0.00 0.00 0.00 174.74 174.07 3iuh h ASN 331 N 7.28 0.00 0.00 1.40 2.35 -1.94 -0.51 115.58 124.17 3iuh h ASN 331 Ca -0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 3iuh h ASN 331 Cb 0.98 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.34 3iuh h ASN 331 CO 0.72 0.51 -0.32 1.33 -1.65 0.00 0.00 177.43 178.02 3iuh n VAL 332 N -3.01 0.73 -4.23 2.81 0.24 -1.26 -4.69 118.33 108.92 3iuh n VAL 332 Ca -0.04 -0.90 -0.14 0.00 -2.04 0.00 0.00 64.34 61.22 3iuh n VAL 332 Cb 0.78 0.22 -0.10 0.00 -1.47 0.00 0.00 33.84 33.28 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 -1.11 0.03 -0.25 3.34 -4.23 -1.26 -5.09 115.64 107.07 3iuh s THR 333 Ca 0.13 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 58.35 3iuh s THR 333 Cb 0.11 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.44 3iuh s THR 333 CO 0.01 0.00 1.38 -0.62 -0.54 0.00 0.00 174.62 174.84 3iuh s ASP 334 N -3.22 6.66 0.29 3.99 -1.08 -1.26 -4.89 116.67 117.16 3iuh s ASP 334 Ca 0.39 1.42 0.03 0.00 -0.52 0.00 0.00 52.55 53.88 3iuh s ASP 334 Cb 0.06 -2.54 0.73 0.00 -1.46 0.00 0.00 42.92 39.71 3iuh s ASP 334 CO 0.16 -1.06 1.67 -0.65 0.52 0.00 0.00 175.17 175.81 3iuh h PRO 335 N 9.42 0.30 -0.55 4.34 0.11 -1.87 -0.45 132.00 143.31 3iuh h PRO 335 Ca -0.28 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.80 3iuh h PRO 335 Cb 1.11 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 3iuh h PRO 335 CO 1.01 0.20 0.30 0.82 -0.21 0.00 0.00 178.00 180.12 3iuh h ILE 336 N 0.31 1.18 -0.64 4.15 2.04 -1.87 -1.04 117.51 121.64 3iuh h ILE 336 Ca 0.56 -0.47 -0.08 0.00 1.00 0.00 0.00 64.86 65.87 3iuh h ILE 336 Cb 1.10 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.66 3iuh h ILE 336 CO -0.58 0.20 0.09 -0.33 0.00 0.00 0.00 178.15 177.53 3iuh h GLU 337 N 0.73 1.07 -0.34 2.37 5.08 -1.51 -1.25 114.58 120.73 3iuh h GLU 337 Ca 0.19 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.20 3iuh h GLU 337 Cb 0.05 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3iuh h GLU 337 CO -0.03 1.00 0.00 0.77 -1.00 0.00 0.00 179.01 179.75 3iuh h SER 338 N 0.98 0.59 -0.79 1.42 0.02 -1.12 -1.31 113.55 113.35 3iuh h SER 338 Ca 0.19 -0.31 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 3iuh h SER 338 Cb 0.45 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.80 3iuh h SER 338 CO 0.02 0.75 0.44 -0.07 -1.14 0.00 0.00 176.83 176.83 3iuh h LEU 339 N 0.41 0.99 0.26 5.07 3.38 -1.07 0.27 115.31 124.61 3iuh h LEU 339 Ca 0.10 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3iuh h LEU 339 Cb 0.45 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3iuh h LEU 339 CO 0.02 0.79 -0.12 0.40 0.09 0.00 0.00 178.44 179.62 3iuh h ILE 340 N 1.11 0.77 0.00 1.22 2.04 -0.94 -0.33 117.51 121.38 3iuh h ILE 340 Ca 0.28 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.98 3iuh h ILE 340 Cb 0.02 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 3iuh h ILE 340 CO -0.05 0.03 -0.06 0.78 0.00 0.00 0.00 178.15 178.86 3iuh h ASN 341 N -0.42 0.00 -0.05 1.72 2.35 -0.99 -1.96 115.58 116.22 3iuh h ASN 341 Ca -0.04 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.62 3iuh h ASN 341 Cb 0.32 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.70 3iuh h ASN 341 CO 0.06 0.06 -0.34 0.28 -1.65 0.00 0.00 177.43 175.84 3iuh h SER 342 N 0.00 0.38 -0.24 5.81 0.02 -0.22 -2.02 113.55 117.27 3iuh h SER 342 Ca -0.00 -0.69 -0.03 0.00 -0.84 0.00 0.00 61.79 60.24 3iuh h SER 342 Cb 0.65 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 3iuh h SER 342 CO 0.01 1.01 0.08 0.00 -1.14 0.00 0.00 176.83 176.79 3iuh h ALA 343 N 0.38 1.56 -0.43 3.77 0.00 -0.91 -1.44 119.26 122.19 3iuh h ALA 343 Ca -0.03 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 3iuh h ALA 343 Cb 1.02 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 3iuh h ALA 343 CO 0.07 0.33 0.03 -0.91 0.00 0.00 0.00 179.25 178.77 3iuh h ASN 344 N 0.44 0.73 -0.44 0.00 -0.26 -1.28 -2.03 115.58 112.74 3iuh h ASN 344 Ca 0.11 -0.29 -0.05 0.00 -0.56 0.00 0.00 56.30 55.51 3iuh h ASN 344 Cb 0.16 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.21 3iuh h ASN 344 CO -0.00 0.84 0.11 -0.33 -1.06 0.00 0.00 177.43 176.98 3iuh h GLU 345 N 0.59 0.78 -0.15 0.81 4.39 -0.59 0.12 114.58 120.53 3iuh h GLU 345 Ca 0.13 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 3iuh h GLU 345 Cb 0.45 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 3iuh h GLU 345 CO 0.02 0.71 0.06 0.82 -1.16 0.00 0.00 179.01 179.46 3iuh h ILE 346 N 0.75 1.15 -0.21 3.13 2.04 -1.10 -1.09 117.51 122.18 3iuh h ILE 346 Ca 0.16 -0.46 -0.07 0.00 1.00 0.00 0.00 64.86 65.49 3iuh h ILE 346 Cb 0.30 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 3iuh h ILE 346 CO 0.00 0.14 -0.18 0.03 0.00 0.00 0.00 178.15 178.14 3iuh h ARG 347 N 0.08 0.36 0.18 2.37 3.08 -0.99 -2.08 114.38 117.38 3iuh h ARG 347 Ca 0.05 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 3iuh h ARG 347 Cb 0.17 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.19 3iuh h ARG 347 CO -0.00 0.54 -0.09 -0.09 -1.07 0.00 0.00 179.97 179.26 3iuh h ARG 348 N 0.33 -0.23 -0.60 0.04 2.43 -0.25 0.17 114.38 116.27 3iuh h ARG 348 Ca 0.06 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 3iuh h ARG 348 Cb 0.52 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 3iuh h ARG 348 CO 0.03 -0.14 0.35 0.00 -1.51 0.00 0.00 179.97 178.71 3iuh h ALA 349 N 0.55 0.77 -0.22 2.80 0.00 -1.11 -1.14 119.26 120.92 3iuh h ALA 349 Ca -0.02 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.84 3iuh h ALA 349 Cb 0.21 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3iuh h ALA 349 CO 0.04 0.27 -0.03 -0.92 0.00 0.00 0.00 179.25 178.61 3iuh h TYR 350 N 0.82 -0.07 -0.16 0.00 3.20 -1.06 0.58 116.97 120.28 3iuh h TYR 350 Ca 0.21 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.12 3iuh h TYR 350 Cb 0.01 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 3iuh h TYR 350 CO -0.02 -0.07 0.05 0.00 -1.64 0.00 0.00 178.16 176.49 3iuh h ALA 351 N 1.21 0.18 -0.78 1.82 0.00 -0.32 -1.40 119.26 119.97 3iuh h ALA 351 Ca 0.11 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3iuh h ALA 351 Cb 0.15 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3iuh h ALA 351 CO -0.21 -0.39 0.41 1.96 0.00 0.00 0.00 179.25 181.03 3iuh h GLN 352 N 0.13 1.09 0.00 0.00 4.20 -0.88 -0.85 115.11 118.79 3iuh h GLN 352 Ca 0.07 -0.13 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 3iuh h GLN 352 Cb 0.05 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 3iuh h GLN 352 CO -0.08 0.81 -0.25 0.00 -0.67 0.00 0.00 178.83 178.64 3iuh h ALA 353 N 1.36 1.47 0.00 3.87 0.00 -0.52 -1.01 119.26 124.43 3iuh h ALA 353 Ca 0.27 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3iuh h ALA 353 Cb 0.05 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3iuh h ALA 353 CO -0.04 0.31 -0.05 1.25 0.00 0.00 0.00 179.25 180.72 3iuh h LEU 354 N 0.00 0.00 -0.25 0.00 5.85 -0.05 -2.85 115.31 118.00 3iuh h LEU 354 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3iuh h LEU 354 Cb 0.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.51 3iuh h LEU 354 CO 0.03 0.05 -0.22 0.18 -0.34 0.00 0.00 178.44 178.14 3iuh n LEU 355 N -3.16 0.61 -4.72 2.25 4.77 -0.39 -4.91 117.00 111.45 3iuh n LEU 355 Ca 0.00 -0.04 -0.42 0.00 -0.03 0.00 0.00 56.01 55.53 3iuh n LEU 355 Cb 0.33 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 3iuh n LEU 355 CO 0.29 0.12 1.21 -0.69 -1.33 0.00 0.00 177.39 176.98 3iuh s VAL 356 N -2.62 2.76 -0.99 4.08 1.01 -1.08 -4.74 120.40 118.81 3iuh s VAL 356 Ca 0.23 0.53 -0.23 0.00 0.00 0.00 0.00 61.98 62.50 3iuh s VAL 356 Cb 0.19 -3.34 0.05 0.00 0.00 0.00 0.00 36.38 33.29 3iuh s VAL 356 CO 0.53 0.04 1.41 -0.62 0.00 0.00 0.00 175.10 176.47 3iuh s ASP 357 N 1.22 6.48 0.28 3.32 -1.08 -1.26 -4.83 116.67 120.80 3iuh s ASP 357 Ca 0.69 -1.41 -0.02 0.00 -0.52 0.00 0.00 52.55 51.30 3iuh s ASP 357 Cb -0.42 -2.56 0.44 0.00 -1.46 0.00 0.00 42.92 38.92 3iuh s ASP 357 CO 0.31 -1.51 1.90 0.03 0.52 0.00 0.00 175.17 176.43 3iuh h ARG 358 N 9.76 1.11 -0.08 4.34 2.47 -1.97 0.23 114.38 130.24 3iuh h ARG 358 Ca 0.16 -0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 58.81 3iuh h ARG 358 Cb 1.01 -0.25 -0.00 0.00 -1.65 0.00 0.00 29.97 29.08 3iuh h ARG 358 CO 1.40 0.73 0.03 0.00 0.56 0.00 0.00 179.97 182.69 3iuh h ALA 359 N 1.47 0.10 -0.66 0.04 0.00 -1.99 0.18 119.26 118.39 3iuh h ALA 359 Ca 0.40 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.16 3iuh h ALA 359 Cb 0.13 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3iuh h ALA 359 CO -0.15 -0.31 0.19 0.00 0.00 0.00 0.00 179.25 178.99 3iuh h ALA 360 N 0.86 0.87 -0.08 0.00 0.00 -1.87 -2.14 119.26 116.90 3iuh h ALA 360 Ca 0.03 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3iuh h ALA 360 Cb 0.18 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3iuh h ALA 360 CO -0.00 0.56 0.05 1.25 0.00 0.00 0.00 179.25 181.10 3iuh h LEU 361 N 0.97 0.10 -1.33 0.00 5.85 -0.37 -1.80 115.31 118.72 3iuh h LEU 361 Ca 0.21 -0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.96 3iuh h LEU 361 Cb 0.32 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 3iuh h LEU 361 CO -0.00 0.11 0.51 -1.28 -0.34 0.00 0.00 178.44 177.44 3iuh h SER 362 N 0.07 0.69 0.23 1.25 0.87 -0.80 -0.97 113.55 114.90 3iuh h SER 362 Ca 0.03 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 3iuh h SER 362 Cb 0.03 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 61.86 3iuh h SER 362 CO -0.01 0.43 -0.11 1.23 -0.53 0.00 0.00 176.83 177.85 3iuh h GLY 363 N 0.78 -0.32 2.00 5.77 0.00 -0.89 -1.56 103.07 108.86 3iuh h GLY 363 Ca 0.35 0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.79 3iuh h GLY 363 CO -0.13 -0.12 -0.03 -0.97 0.00 0.00 0.00 176.54 175.30 3iuh h TYR 364 N -0.55 0.00 0.09 5.60 0.05 -0.78 -1.03 116.97 120.35 3iuh h TYR 364 Ca -0.03 0.00 -0.29 0.00 0.05 0.00 0.00 58.73 58.46 3iuh h TYR 364 Cb 0.40 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.17 3iuh h TYR 364 CO 0.00 0.03 -1.20 1.96 -1.05 0.00 0.00 178.16 177.90 3iuh h GLN 365 N 0.00 0.64 -0.27 4.88 4.20 -1.04 0.14 115.11 123.66 3iuh h GLN 365 Ca -0.00 -0.81 -0.11 0.00 0.06 0.00 0.00 58.65 57.79 3iuh h GLN 365 Cb 0.08 0.26 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 3iuh h GLN 365 CO 0.00 1.36 -0.31 0.93 -0.67 0.00 0.00 178.83 180.15 3iuh h GLU 366 N 0.30 0.56 -0.00 1.46 4.39 -0.43 -2.86 114.58 118.00 3iuh h GLU 366 Ca -0.17 -0.24 0.00 0.00 0.34 0.00 0.00 59.36 59.28 3iuh h GLU 366 Cb 1.87 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.50 3iuh h GLU 366 CO 0.23 0.80 -0.20 -0.25 -1.16 0.00 0.00 179.01 178.44 3iuh n ASP 367 N -4.08 0.54 -2.58 1.42 8.00 -0.47 -4.94 116.55 114.44 3iuh n ASP 367 Ca -0.01 -0.47 -0.17 0.00 0.71 0.00 0.00 54.79 54.85 3iuh n ASP 367 Cb 0.45 -0.02 0.05 0.00 -0.02 0.00 0.00 41.12 41.58 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 -1.04 -5.14 -4.21 -2.24 5.03 -0.84 -4.92 115.26 101.90 3iuh n ASN 368 Ca 0.12 -0.32 -0.44 0.00 0.87 0.00 0.00 54.58 54.81 3iuh n ASN 368 Cb 0.31 -3.85 0.00 0.00 -1.02 0.00 0.00 39.78 35.23 3iuh n ASN 368 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 3iuh n ASP 369 N -1.66 5.59 -0.33 6.41 -0.08 0.44 -4.85 116.55 122.07 3iuh n ASP 369 Ca -0.03 -3.12 0.07 0.00 -1.51 0.00 0.00 54.79 50.19 3iuh n ASP 369 Cb 0.56 -1.42 0.23 0.00 2.34 0.00 0.00 41.12 42.84 3iuh n ASP 369 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3iuh h ALA 370 N 6.33 1.40 0.38 -1.67 0.00 -1.92 -0.58 119.26 123.21 3iuh h ALA 370 Ca 0.26 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 3iuh h ALA 370 Cb 0.77 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3iuh h ALA 370 CO 1.26 0.07 -0.21 1.25 0.00 0.00 0.00 179.25 181.62 3iuh h LEU 371 N 0.81 -0.52 -1.22 0.00 5.85 -1.95 -1.76 115.31 116.52 3iuh h LEU 371 Ca 0.48 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 59.15 3iuh h LEU 371 Cb 0.57 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 3iuh h LEU 371 CO -0.31 -0.35 -0.34 0.24 -0.34 0.00 0.00 178.44 177.35 3iuh h MET 372 N -0.56 0.00 -0.05 1.25 2.86 -1.89 -1.66 114.93 114.89 3iuh h MET 372 Ca -0.05 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 3iuh h MET 372 Cb 0.44 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.10 3iuh h MET 372 CO 0.06 0.34 0.00 0.00 1.06 0.00 0.00 176.91 178.37 3iuh h ALA 373 N 1.66 0.06 -0.27 6.32 0.00 -0.88 0.35 119.26 126.51 3iuh h ALA 373 Ca -0.00 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 3iuh h ALA 373 Cb 0.72 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3iuh h ALA 373 CO 0.04 -0.28 -0.23 0.00 0.00 0.00 0.00 179.25 178.78 3iuh h THR 374 N -0.19 1.26 0.00 0.00 1.03 -1.19 -2.21 112.91 111.62 3iuh h THR 374 Ca 0.01 -1.25 -0.09 0.00 -0.01 0.00 0.00 66.41 65.07 3iuh h THR 374 Cb 0.30 1.31 -0.01 0.00 -1.07 0.00 0.00 68.15 68.68 3iuh h THR 374 CO 0.00 0.40 -0.45 -0.08 -0.01 0.00 0.00 175.52 175.38 3iuh h GLU 375 N 0.45 0.00 -0.41 0.00 4.57 -1.18 -0.28 114.58 117.74 3iuh h GLU 375 Ca 0.07 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.15 3iuh h GLU 375 Cb 0.66 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.23 3iuh h GLU 375 CO 0.05 0.45 -0.16 1.15 -1.18 0.00 0.00 179.01 179.32 3iuh h THR 376 N 0.00 1.26 -0.21 0.32 2.02 -0.31 -0.10 112.91 115.88 3iuh h THR 376 Ca -0.00 -1.23 -0.15 0.00 0.77 0.00 0.00 66.41 65.79 3iuh h THR 376 Cb 0.84 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 3iuh h THR 376 CO 0.06 0.42 -0.47 0.25 0.37 0.00 0.00 175.52 176.14 3iuh h LEU 377 N 0.69 0.78 -0.98 2.58 5.85 -1.08 -3.25 115.31 119.90 3iuh h LEU 377 Ca 0.11 -0.56 -0.06 0.00 0.84 0.00 0.00 57.88 58.22 3iuh h LEU 377 Cb 0.64 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 3iuh h LEU 377 CO 0.05 1.20 0.11 0.11 -0.34 0.00 0.00 178.44 179.56 3iuh h LYS 378 N 0.40 0.84 -0.26 1.25 1.79 -0.71 -1.26 116.57 118.62 3iuh h LYS 378 Ca 0.00 -0.19 0.04 0.00 -2.18 0.00 0.00 60.65 58.32 3iuh h LYS 378 Cb 1.08 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 31.60 3iuh h LYS 378 CO 0.10 0.78 0.18 0.00 -1.08 0.00 0.00 179.45 179.43 3iuh h ARG 379 N 0.81 0.19 0.02 3.15 3.08 -1.05 0.65 114.38 121.22 3iuh h ARG 379 Ca 0.17 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 3iuh h ARG 379 Cb 0.33 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3iuh h ARG 379 CO 0.00 0.12 -0.20 0.00 -1.07 0.00 0.00 179.97 178.83 3iuh h ALA 380 N 1.86 -0.00 -0.97 0.04 0.00 -1.51 -3.29 119.26 115.39 3iuh h ALA 380 Ca 0.11 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3iuh h ALA 380 Cb 0.21 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3iuh h ALA 380 CO -0.02 0.10 0.62 -0.92 0.00 0.00 0.00 179.25 179.03 3iuh h TYR 381 N -0.89 1.24 0.00 0.00 3.20 -0.60 -2.06 116.97 117.86 3iuh h TYR 381 Ca -0.04 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 3iuh h TYR 381 Cb 1.12 -0.41 0.00 0.00 1.54 0.00 0.00 36.73 38.98 3iuh h TYR 381 CO 0.26 0.80 0.00 0.54 -1.64 0.00 0.00 178.16 178.11 3iuh n ARG 382 N -4.37 0.15 -2.27 1.82 1.74 0.22 -4.74 116.66 109.21 3iuh n ARG 382 Ca 0.11 0.41 -0.42 0.00 -0.77 0.00 0.00 57.85 57.17 3iuh n ARG 382 Cb 0.03 -1.80 -0.03 0.00 -1.02 0.00 0.00 32.46 29.64 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 -3.27 3.88 -0.86 0.55 2.01 -0.77 -4.94 115.64 112.23 3iuh s THR 383 Ca 0.04 1.20 -0.25 0.00 0.31 0.00 0.00 61.69 62.99 3iuh s THR 383 Cb 0.09 -3.77 0.03 0.00 0.01 0.00 0.00 72.50 68.86 3iuh s THR 383 CO 0.35 -0.03 1.39 -0.62 -0.69 0.00 0.00 174.62 175.02 3iuh s ASP 384 N 2.03 6.25 0.00 3.53 2.15 -1.26 -4.85 116.67 124.52 3iuh s ASP 384 Ca 0.62 -0.86 0.08 0.00 0.43 0.00 0.00 52.55 52.83 3iuh s ASP 384 Cb -0.29 -2.56 0.25 0.00 -0.30 0.00 0.00 42.92 40.01 3iuh s ASP 384 CO 0.24 -1.74 1.20 1.33 -0.17 0.00 0.00 175.17 176.02 3iuh n VAL 385 N 6.67 0.30 -0.29 1.11 0.24 -1.26 -4.37 118.33 120.73 3iuh n VAL 385 Ca 0.17 -0.31 0.08 0.00 -2.04 0.00 0.00 64.34 62.25 3iuh n VAL 385 Cb 0.50 0.16 0.24 0.00 -1.47 0.00 0.00 33.84 33.26 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 1.37 0.56 -1.00 7.34 4.57 -1.98 -0.28 114.58 125.16 3iuh h GLU 386 Ca 0.00 -0.03 0.09 0.00 -1.18 0.00 0.00 59.36 58.24 3iuh h GLU 386 Cb 0.31 -0.13 -0.08 0.00 -0.16 0.00 0.00 28.75 28.70 3iuh h GLU 386 CO 0.00 0.37 0.63 -1.35 -1.18 0.00 0.00 179.01 177.48 3iuh h PRO 387 N 0.57 1.04 0.18 0.92 0.11 -1.93 0.35 132.00 133.24 3iuh h PRO 387 Ca 0.47 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.51 3iuh h PRO 387 Cb 0.72 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.60 3iuh h PRO 387 CO -0.39 0.69 -0.09 0.82 -0.21 0.00 0.00 178.00 178.82 3iuh h ILE 388 N 1.07 0.91 -0.61 4.15 2.04 -1.40 -0.78 117.51 122.88 3iuh h ILE 388 Ca 0.46 -0.43 0.08 0.00 1.00 0.00 0.00 64.86 65.98 3iuh h ILE 388 Cb 0.34 1.17 -0.07 0.00 -0.74 0.00 0.00 36.82 37.52 3iuh h ILE 388 CO -0.22 0.10 0.27 -0.07 0.00 0.00 0.00 178.15 178.22 3iuh h LEU 389 N -0.45 0.32 -0.58 1.44 4.07 -0.75 0.14 115.31 119.50 3iuh h LEU 389 Ca -0.02 0.06 -0.15 0.00 0.08 0.00 0.00 57.88 57.85 3iuh h LEU 389 Cb 0.35 0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.10 3iuh h LEU 389 CO 0.04 0.19 -0.46 0.00 -1.08 0.00 0.00 178.44 177.14 3iuh h ALA 390 N 1.39 0.76 -0.14 1.53 0.00 -0.91 -2.09 119.26 119.80 3iuh h ALA 390 Ca 0.30 -0.47 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 3iuh h ALA 390 Cb 0.32 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3iuh h ALA 390 CO -0.26 0.66 -0.58 1.49 0.00 0.00 0.00 179.25 180.56 3iuh h GLU 391 N 0.49 0.44 -0.50 0.00 4.57 -0.67 -0.75 114.58 118.15 3iuh h GLU 391 Ca 0.03 -0.29 -0.03 0.00 -1.18 0.00 0.00 59.36 57.89 3iuh h GLU 391 Cb 0.98 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.59 3iuh h GLU 391 CO 0.09 0.89 0.20 0.00 -1.18 0.00 0.00 179.01 179.01 3iuh h ALA 392 N 1.04 0.65 -0.11 2.92 0.00 -0.61 -0.76 119.26 122.40 3iuh h ALA 392 Ca -0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3iuh h ALA 392 Cb 1.11 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 3iuh h ALA 392 CO 0.10 0.27 0.01 0.00 0.00 0.00 0.00 179.25 179.63 3iuh h ARG 393 N 0.67 0.19 -0.65 0.00 3.08 -1.23 -2.57 114.38 113.87 3iuh h ARG 393 Ca 0.17 -0.06 0.07 0.00 0.07 0.00 0.00 59.98 60.22 3iuh h ARG 393 Cb 0.20 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.18 3iuh h ARG 393 CO -0.01 0.43 0.34 -0.09 -1.07 0.00 0.00 179.97 179.57 3iuh h ARG 394 N -0.06 0.61 0.00 0.04 2.43 -0.97 0.61 114.38 117.03 3iuh h ARG 394 Ca 0.03 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 3iuh h ARG 394 Cb 0.34 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3iuh h ARG 394 CO 0.00 0.40 -0.16 0.00 -1.51 0.00 0.00 179.97 178.71 3iuh h ARG 395 N 0.62 0.00 -0.46 0.20 3.08 -1.07 -3.13 114.38 113.62 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 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 3iuh h ARG 395 CO -0.21 0.16 0.00 0.25 -1.07 0.00 0.00 179.97 179.10 3iuh n THR 396 N -3.57 2.05 -0.60 2.04 -2.24 -0.62 -4.93 114.28 106.41 3iuh n THR 396 Ca -0.01 -1.44 0.00 0.00 -2.27 0.00 0.00 64.05 60.33 3iuh n THR 396 Cb 0.30 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 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 0.40 0.68 0.00 3.38 0.00 -0.98 -4.96 105.19 103.70 3iuh n GLY 397 Ca 0.23 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.60 1.68 3.52 -0.02 0.00 0.20 -4.76 105.19 103.23 3iuh n GLY 398 Ca 0.00 -2.07 -0.33 0.00 0.00 0.00 0.00 46.02 43.61 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 -2.16 2.86 0.17 4.61 0.00 -0.41 -4.25 121.76 122.58 3iuh s ALA 399 Ca 0.00 -0.90 -0.14 0.00 0.00 0.00 0.00 51.96 50.91 3iuh s ALA 399 Cb 0.00 -1.20 0.13 0.00 0.00 0.00 0.00 23.12 22.05 3iuh s ALA 399 CO 0.00 0.49 1.74 0.28 0.00 0.00 0.00 175.76 178.27 3iuh h VAL 400 N 4.51 0.83 -3.23 0.00 2.07 -1.89 -3.25 116.25 115.28 3iuh h VAL 400 Ca -0.43 -0.10 -0.63 0.00 0.82 0.00 0.00 66.70 66.36 3iuh h VAL 400 Cb 1.17 0.52 -0.41 0.00 -1.52 0.00 0.00 31.29 31.06 3iuh h VAL 400 CO 0.53 0.05 -0.66 -0.62 0.02 0.00 0.00 177.57 176.90 3iuh s ASP 401 N -5.35 4.14 0.16 0.57 -1.08 -1.26 -4.67 116.67 109.18 3iuh s ASP 401 Ca -0.13 -2.99 -0.25 0.00 -0.52 0.00 0.00 52.55 48.66 3iuh s ASP 401 Cb 0.14 -1.46 0.04 0.00 -1.46 0.00 0.00 42.92 40.17 3iuh s ASP 401 CO 0.72 -0.23 1.58 -0.65 0.52 0.00 0.00 175.17 177.12 3iuh h PRO 402 N 6.44 -0.26 -0.73 4.34 0.11 -1.86 -1.75 132.00 138.29 3iuh h PRO 402 Ca -0.03 0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.06 3iuh h PRO 402 Cb 0.89 0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.02 3iuh h PRO 402 CO 0.63 -0.18 0.31 0.28 -0.21 0.00 0.00 178.00 178.83 3iuh h VAL 403 N -0.27 1.24 -0.71 3.15 2.07 -1.94 -0.01 116.25 119.78 3iuh h VAL 403 Ca 0.16 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 3iuh h VAL 403 Cb 0.57 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 3iuh h VAL 403 CO -0.59 0.30 0.35 0.00 0.02 0.00 0.00 177.57 177.65 3iuh h ALA 404 N 1.29 0.91 -0.41 1.67 0.00 -1.88 -0.24 119.26 120.58 3iuh h ALA 404 Ca 0.25 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 3iuh h ALA 404 Cb 0.17 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3iuh h ALA 404 CO -0.02 0.46 -0.21 1.15 0.00 0.00 0.00 179.25 180.63 3iuh h THR 405 N 0.98 1.28 -0.22 0.00 2.02 -0.96 0.33 112.91 116.34 3iuh h THR 405 Ca 0.24 -1.35 0.02 0.00 0.77 0.00 0.00 66.41 66.10 3iuh h THR 405 Cb 0.10 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 3iuh h THR 405 CO -0.03 0.45 0.06 0.22 0.37 0.00 0.00 175.52 176.60 3iuh h TYR 406 N 0.69 0.11 -0.59 3.16 3.20 -0.64 -0.16 116.97 122.74 3iuh h TYR 406 Ca 0.09 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.89 3iuh h TYR 406 Cb 0.77 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.00 3iuh h TYR 406 CO 0.06 0.05 0.02 0.00 -1.64 0.00 0.00 178.16 176.65 3iuh h ARG 407 N 0.16 1.01 0.00 1.82 3.08 -0.90 -2.56 114.38 116.99 3iuh h ARG 407 Ca 0.10 -0.30 -0.05 0.00 0.07 0.00 0.00 59.98 59.80 3iuh h ARG 407 Cb 0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 3iuh h ARG 407 CO -0.11 0.97 -0.24 0.00 -1.07 0.00 0.00 179.97 179.52 3iuh h ALA 408 N 1.09 1.52 0.00 0.04 0.00 -0.47 -2.73 119.26 118.70 3iuh h ALA 408 Ca 0.17 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 3iuh h ALA 408 Cb 0.51 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3iuh h ALA 408 CO 0.02 0.30 -0.25 0.66 0.00 0.00 0.00 179.25 179.98 3iuh h SER 409 N 0.00 0.00 -0.34 0.00 4.64 -0.61 -3.47 113.55 113.77 3iuh h SER 409 Ca -0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 3iuh h SER 409 Cb 0.44 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.48 3iuh h SER 409 CO 0.03 0.25 -0.13 0.61 -0.87 0.00 0.00 176.83 176.72 3iuh n GLY 410 N 0.46 0.93 0.20 -0.77 0.00 -1.03 -4.94 105.19 100.04 3iuh n GLY 410 Ca 0.01 -0.72 -0.08 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.37 -0.28 1.61 3.20 -1.85 0.77 116.97 120.05 3iuh h TYR 411 Ca -0.15 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.81 3iuh h TYR 411 Cb 0.46 0.20 -0.06 0.00 1.54 0.00 0.00 36.73 38.88 3iuh h TYR 411 CO 0.20 -0.22 -0.09 -0.09 -1.64 0.00 0.00 178.16 176.32 3iuh h ARG 412 N -0.14 -0.03 -0.97 1.82 9.65 -1.92 0.11 114.38 122.91 3iuh h ARG 412 Ca 0.13 0.00 0.02 0.00 -1.10 0.00 0.00 59.98 59.03 3iuh h ARG 412 Cb 0.33 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 28.86 3iuh h ARG 412 CO -0.31 -0.02 0.64 0.00 2.80 0.00 0.00 179.97 183.08 3iuh h ALA 413 N 1.24 1.34 0.18 2.80 0.00 -1.86 -0.68 119.26 122.28 3iuh h ALA 413 Ca 0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 3iuh h ALA 413 Cb 0.24 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3iuh h ALA 413 CO -0.30 0.59 -0.11 -0.09 0.00 0.00 0.00 179.25 179.33 3iuh h ARG 414 N 1.27 -0.27 0.00 0.00 2.43 0.12 -2.44 114.38 115.48 3iuh h ARG 414 Ca 0.37 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.49 3iuh h ARG 414 Cb -0.07 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 3iuh h ARG 414 CO -0.10 -0.18 -0.30 -0.39 -1.51 0.00 0.00 179.97 177.49 3iuh h VAL 415 N -0.28 0.97 -0.38 0.20 -1.51 -0.60 -2.59 116.25 112.05 3iuh h VAL 415 Ca -0.02 -1.15 -0.04 0.00 -1.23 0.00 0.00 66.70 64.27 3iuh h VAL 415 Cb 0.23 1.67 -0.02 0.00 -2.13 0.00 0.00 31.29 31.04 3iuh h VAL 415 CO 0.02 0.30 0.07 0.00 -1.23 0.00 0.00 177.57 176.73 3iuh h ALA 416 N 1.70 1.41 0.00 5.19 0.00 -0.78 0.09 119.26 126.86 3iuh h ALA 416 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3iuh h ALA 416 Cb 0.64 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3iuh h ALA 416 CO 0.04 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.71 3iuh n ALA 417 N -2.47 2.31 -0.03 0.00 0.00 -0.95 -3.47 120.51 115.89 3iuh n ALA 417 Ca 0.02 -0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.45 3iuh n ALA 417 Cb 0.21 -1.47 -0.16 0.00 0.00 0.00 0.00 19.45 18.02 3iuh n ALA 417 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3iuh n GLU 418 N -1.81 0.68 -4.56 0.00 1.02 -0.59 -4.93 120.64 110.44 3iuh n GLU 418 Ca 0.06 -0.15 -0.33 0.00 -0.02 0.00 0.00 57.16 56.72 3iuh n GLU 418 Cb 0.38 -1.51 -0.15 0.00 -0.02 0.00 0.00 31.44 30.14 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 -3.23 3.27 0.04 3.49 0.52 -0.08 -5.10 118.95 117.86 3iuh s ARG 419 Ca -0.08 -0.73 -0.30 0.00 -0.52 0.00 0.00 55.73 54.10 3iuh s ARG 419 Cb 0.12 -2.65 -0.05 0.00 0.52 0.00 0.00 34.95 32.88 3iuh s ARG 419 CO 0.87 0.05 1.22 -2.14 0.02 0.00 0.00 175.30 175.32 3iuh s PRO 420 N 0.74 4.40 0.81 3.54 0.02 -1.26 -4.63 135.00 138.62 3iuh s PRO 420 Ca -0.06 1.77 -0.10 0.00 0.02 0.00 0.00 61.00 62.63 3iuh s PRO 420 Cb -0.15 -3.40 0.12 0.00 0.02 0.00 0.00 34.50 31.09 3iuh s PRO 420 CO 0.01 -0.32 1.15 0.00 -0.33 0.00 0.00 177.00 177.51 3iuh s ALA 421 N 1.36 2.82 0.18 -1.55 0.00 -1.26 -4.94 121.76 118.37 3iuh s ALA 421 Ca 0.59 -1.08 -0.09 0.00 0.00 0.00 0.00 51.96 51.38 3iuh s ALA 421 Cb -0.29 -2.65 0.06 0.00 0.00 0.00 0.00 23.12 20.24 3iuh s ALA 421 CO 0.28 -1.78 1.60 0.77 0.00 0.00 0.00 175.76 176.62 3iuh h SER 422 N -1.03 1.00 -4.57 0.00 0.02 -1.97 -3.45 113.55 103.56 3iuh h SER 422 Ca -0.44 -0.34 -0.26 0.00 -0.84 0.00 0.00 61.79 59.91 3iuh h SER 422 Cb 1.28 -0.27 -0.15 0.00 0.14 0.00 0.00 62.40 63.40 3iuh h SER 422 CO 0.51 1.13 -0.68 0.68 -1.14 0.00 0.00 176.83 177.34 3iuh s VAL 423 N -4.79 0.67 -2.00 2.27 -7.23 -1.26 -5.33 120.40 102.74 3iuh s VAL 423 Ca -0.11 -1.96 0.14 0.00 -1.81 0.00 0.00 61.98 58.24 3iuh s VAL 423 Cb 0.13 -1.96 0.41 0.00 0.56 0.00 0.00 36.38 35.52 3iuh s VAL 423 CO 0.86 -0.62 1.27 0.00 -0.31 0.00 0.00 175.10 176.30