#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fga n ASP 8 N 0.00 0.66 -0.39 1.67 3.85 -1.26 -4.99 116.55 116.09 3fga n ASP 8 Ca 0.00 0.00 -0.07 0.00 -0.71 0.00 0.00 54.79 54.01 3fga n ASP 8 Cb 0.00 0.00 -0.05 0.00 -1.35 0.00 0.00 41.12 39.72 3fga n ASP 8 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.20 175.95 3fga n SER 9 N 0.00 -0.88 -1.65 -1.12 2.88 -1.26 -1.95 113.62 109.65 3fga n SER 9 Ca 0.00 1.69 0.09 0.00 -1.33 0.00 0.00 58.87 59.32 3fga n SER 9 Cb 0.00 -0.28 0.37 0.00 -0.75 0.00 0.00 64.21 63.55 3fga n SER 9 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3fga n LEU 10 N -5.27 4.91 -0.26 2.46 4.77 -1.26 -4.55 117.00 117.80 3fga n LEU 10 Ca 0.05 -2.48 0.05 0.00 -0.03 0.00 0.00 56.01 53.60 3fga n LEU 10 Cb 0.30 -0.60 0.16 0.00 -2.33 0.00 0.00 43.42 40.94 3fga n LEU 10 CO -0.15 0.77 0.83 0.22 -1.33 0.00 0.00 177.39 177.73 3fga h TYR 11 N 4.05 -0.04 0.00 -1.77 5.03 -1.78 -0.57 116.97 121.90 3fga h TYR 11 Ca 0.00 0.06 -0.01 0.00 2.58 0.00 0.00 58.73 61.36 3fga h TYR 11 Cb 1.54 0.14 -0.00 0.00 1.55 0.00 0.00 36.73 39.96 3fga h TYR 11 CO 0.83 -0.24 -0.04 -1.35 -1.32 0.00 0.00 178.16 176.05 3fga h PRO 12 N 0.11 0.00 -0.19 1.82 0.11 -1.81 -2.01 132.00 130.02 3fga h PRO 12 Ca 0.41 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.34 3fga h PRO 12 Cb 0.73 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.85 3fga h PRO 12 CO -0.66 0.04 -0.59 0.82 -0.21 0.00 0.00 178.00 177.39 3fga h ILE 13 N 0.00 1.30 -0.49 4.15 2.04 -1.46 -2.68 117.51 120.36 3fga h ILE 13 Ca -0.00 -1.81 0.08 0.00 1.00 0.00 0.00 64.86 64.13 3fga h ILE 13 Cb 0.07 1.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.99 3fga h ILE 13 CO 0.00 0.57 0.13 0.00 0.00 0.00 0.00 178.15 178.85 3fga h ALA 14 N 0.58 0.57 -0.47 1.87 0.00 -0.91 0.33 119.26 121.23 3fga h ALA 14 Ca -0.02 0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3fga h ALA 14 Cb 1.21 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 3fga h ALA 14 CO 0.13 -0.28 0.29 0.28 0.00 0.00 0.00 179.25 179.67 3fga h VAL 15 N 0.28 1.08 -0.19 0.00 2.07 -1.40 -0.98 116.25 117.10 3fga h VAL 15 Ca 0.24 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.61 3fga h VAL 15 Cb 0.31 0.44 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 3fga h VAL 15 CO -0.29 0.11 -0.09 0.25 0.02 0.00 0.00 177.57 177.56 3fga h LEU 16 N 0.59 -0.30 -0.45 2.57 6.46 -1.07 -0.33 115.31 122.78 3fga h LEU 16 Ca 0.18 0.07 0.08 0.00 -0.12 0.00 0.00 57.88 58.10 3fga h LEU 16 Cb -0.02 0.17 -0.07 0.00 -0.73 0.00 0.00 40.66 40.00 3fga h LEU 16 CO -0.06 -0.12 0.01 0.40 -0.62 0.00 0.00 178.44 178.05 3fga h ILE 17 N -0.07 0.67 -0.34 4.05 2.04 -0.59 0.21 117.51 123.48 3fga h ILE 17 Ca 0.10 -0.04 0.06 0.00 1.00 0.00 0.00 64.86 65.98 3fga h ILE 17 Cb 0.22 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 36.77 3fga h ILE 17 CO -0.23 0.02 -0.02 -0.78 0.00 0.00 0.00 178.15 177.14 3fga h ASP 18 N 0.13 -0.18 0.25 1.72 1.82 -0.78 -0.53 116.42 118.85 3fga h ASP 18 Ca 0.23 0.08 -0.06 0.00 -0.39 0.00 0.00 57.03 56.88 3fga h ASP 18 Cb 0.33 0.15 -0.01 0.00 0.68 0.00 0.00 39.33 40.48 3fga h ASP 18 CO -0.36 -0.05 -0.28 -0.33 -1.61 0.00 0.00 179.24 176.60 3fga h GLU 19 N 0.07 0.06 -0.00 0.28 4.39 0.01 -1.74 114.58 117.65 3fga h GLU 19 Ca 0.17 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.85 3fga h GLU 19 Cb 0.23 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 3fga h GLU 19 CO -0.29 0.34 -0.36 1.28 -1.16 0.00 0.00 179.01 178.82 3fga n LEU 20 N -4.18 0.44 0.14 1.33 4.77 -0.04 -2.91 117.00 116.55 3fga n LEU 20 Ca -0.02 0.08 0.12 0.00 -0.03 0.00 0.00 56.01 56.17 3fga n LEU 20 Cb 0.34 -0.29 0.24 0.00 -2.33 0.00 0.00 43.42 41.39 3fga n LEU 20 CO 0.38 0.10 0.69 -0.09 -1.33 0.00 0.00 177.39 177.14 3fga h ARG 21 N 0.12 0.00 -6.96 3.23 9.65 -0.19 -3.47 114.38 116.76 3fga h ARG 21 Ca 0.00 0.00 -0.53 0.00 -1.10 0.00 0.00 59.98 58.35 3fga h ARG 21 Cb 0.49 0.00 0.20 0.00 -1.39 0.00 0.00 29.97 29.27 3fga h ARG 21 CO 0.00 0.00 -0.19 -1.71 2.80 0.00 0.00 179.97 180.87 3fga n ASN 22 N -2.59 -0.79 -0.03 -3.80 2.85 -1.04 -4.98 115.26 104.88 3fga n ASN 22 Ca 0.04 0.44 0.07 0.00 -0.11 0.00 0.00 54.58 55.01 3fga n ASN 22 Cb 0.48 -1.33 -0.16 0.00 1.24 0.00 0.00 39.78 40.01 3fga n ASN 22 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 3fga n GLU 23 N -2.46 0.67 -2.24 1.20 1.02 -1.26 -4.79 120.64 112.78 3fga n GLU 23 Ca 0.10 -0.15 -0.40 0.00 -0.02 0.00 0.00 57.16 56.68 3fga n GLU 23 Cb 0.52 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.42 3fga n GLU 23 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3fga s ASP 24 N -4.59 5.68 0.33 1.62 3.68 -1.26 -4.86 116.67 117.28 3fga s ASP 24 Ca -0.08 0.13 0.12 0.00 2.13 0.00 0.00 52.55 54.85 3fga s ASP 24 Cb 0.12 -2.54 1.00 0.00 -1.45 0.00 0.00 42.92 40.05 3fga s ASP 24 CO 0.85 -2.10 1.66 0.58 0.13 0.00 0.00 175.17 176.29 3fga h VAL 25 N 6.56 0.30 -0.26 1.11 2.07 -1.98 0.15 116.25 124.19 3fga h VAL 25 Ca -0.27 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.17 3fga h VAL 25 Cb 1.12 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 3fga h VAL 25 CO 1.22 0.05 0.18 1.56 0.02 0.00 0.00 177.57 180.61 3fga h GLN 26 N 0.30 0.27 -0.05 1.57 1.08 -2.00 -1.82 115.11 114.46 3fga h GLN 26 Ca 0.69 -0.02 -0.24 0.00 -1.45 0.00 0.00 58.65 57.64 3fga h GLN 26 Cb 1.55 -0.06 0.01 0.00 -0.05 0.00 0.00 27.48 28.93 3fga h GLN 26 CO -0.62 0.18 -0.93 -0.07 -0.95 0.00 0.00 178.83 176.43 3fga h LEU 27 N 0.27 0.83 -0.80 1.46 4.07 -1.07 -2.78 115.31 117.29 3fga h LEU 27 Ca 0.11 -0.62 0.03 0.00 0.08 0.00 0.00 57.88 57.47 3fga h LEU 27 Cb 0.09 -0.25 -0.05 0.00 1.08 0.00 0.00 40.66 41.53 3fga h LEU 27 CO -0.02 1.42 0.52 0.03 -1.08 0.00 0.00 178.44 179.31 3fga h ARG 28 N 0.40 0.99 -0.67 1.13 3.08 -1.21 -2.60 114.38 115.52 3fga h ARG 28 Ca -0.09 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 59.93 3fga h ARG 28 Cb 1.57 -0.22 -0.04 0.00 0.08 0.00 0.00 29.97 31.35 3fga h ARG 28 CO 0.18 0.66 0.41 -0.07 -1.07 0.00 0.00 179.97 180.08 3fga h LEU 29 N 1.02 0.66 -1.10 3.04 4.07 -1.31 -2.39 115.31 119.31 3fga h LEU 29 Ca 0.31 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 58.22 3fga h LEU 29 Cb -0.03 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 41.56 3fga h LEU 29 CO -0.10 0.46 -0.02 0.78 -1.08 0.00 0.00 178.44 178.48 3fga h ASN 30 N 0.80 0.58 0.25 -0.43 2.35 -1.18 0.29 115.58 118.23 3fga h ASN 30 Ca 0.27 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3fga h ASN 30 Cb 0.04 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 3fga h ASN 30 CO -0.12 0.67 -0.26 0.28 -1.65 0.00 0.00 177.43 176.35 3fga h SER 31 N 0.58 -0.69 -0.46 5.81 0.02 -1.25 -2.50 113.55 115.05 3fga h SER 31 Ca 0.12 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 3fga h SER 31 Cb 0.40 0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 3fga h SER 31 CO 0.02 -0.37 0.22 0.40 -1.14 0.00 0.00 176.83 175.96 3fga h ILE 32 N -0.54 1.18 0.00 3.27 1.08 -0.88 -0.15 117.51 121.47 3fga h ILE 32 Ca -0.00 -0.53 -0.01 0.00 -0.39 0.00 0.00 64.86 63.92 3fga h ILE 32 Cb 0.50 0.55 -0.00 0.00 -3.07 0.00 0.00 36.82 34.81 3fga h ILE 32 CO -0.06 0.21 -0.06 0.11 -0.69 0.00 0.00 178.15 177.66 3fga h LYS 33 N 0.71 0.00 -0.44 2.37 1.57 -0.81 -2.61 116.57 117.35 3fga h LYS 33 Ca 0.18 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.80 3fga h LYS 33 Cb 0.11 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.33 3fga h LYS 33 CO -0.02 0.06 0.08 1.17 -0.57 0.00 0.00 179.45 180.17 3fga n LYS 34 N -3.35 2.59 0.23 3.15 3.00 -0.11 -4.65 118.16 119.03 3fga n LYS 34 Ca -0.01 -3.04 0.12 0.00 -0.00 0.00 0.00 58.31 55.38 3fga n LYS 34 Cb 0.23 -1.93 0.48 0.00 0.00 0.00 0.00 35.03 33.80 3fga n LYS 34 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 3fga h LEU 35 N 1.57 0.00 0.00 3.14 5.85 -1.06 -2.56 115.31 122.26 3fga h LEU 35 Ca 0.19 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 3fga h LEU 35 Cb 1.81 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.84 3fga h LEU 35 CO 0.46 0.16 -0.15 0.77 -0.34 0.00 0.00 178.44 179.34 3fga h SER 36 N 0.00 0.00 -0.07 1.25 4.64 -1.84 -2.74 113.55 114.78 3fga h SER 36 Ca -0.00 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.07 3fga h SER 36 Cb 0.73 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.84 3fga h SER 36 CO 0.02 0.11 -0.91 0.74 -0.87 0.00 0.00 176.83 175.92 3fga h THR 37 N 0.00 1.28 -0.19 2.95 2.02 -1.82 -1.80 112.91 115.35 3fga h THR 37 Ca -0.00 -2.11 0.05 0.00 0.77 0.00 0.00 66.41 65.12 3fga h THR 37 Cb 1.09 2.19 -0.06 0.00 -1.74 0.00 0.00 68.15 69.63 3fga h THR 37 CO 0.01 0.66 -0.17 0.40 0.37 0.00 0.00 175.52 176.80 3fga h ILE 38 N 0.46 0.54 -0.71 3.11 1.08 -1.51 -0.57 117.51 119.92 3fga h ILE 38 Ca -0.09 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.35 3fga h ILE 38 Cb 1.56 0.54 -0.03 0.00 -3.07 0.00 0.00 36.82 35.82 3fga h ILE 38 CO 0.18 0.00 0.35 0.00 -0.69 0.00 0.00 178.15 178.00 3fga h ALA 39 N 0.92 0.91 -0.56 1.87 0.00 -1.42 -0.97 119.26 120.02 3fga h ALA 39 Ca 0.12 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3fga h ALA 39 Cb 0.35 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3fga h ALA 39 CO -0.30 0.46 0.05 -0.07 0.00 0.00 0.00 179.25 179.40 3fga h LEU 40 N 0.99 0.89 0.13 0.00 3.38 -1.19 -3.02 115.31 116.49 3fga h LEU 40 Ca 0.25 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3fga h LEU 40 Cb 0.10 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.61 3fga h LEU 40 CO -0.03 0.92 -0.07 0.00 0.09 0.00 0.00 178.44 179.35 3fga h ALA 41 N 1.18 -0.18 -2.26 1.53 0.00 -0.28 -3.43 119.26 115.82 3fga h ALA 41 Ca 0.17 -0.04 -0.49 0.00 0.00 0.00 0.00 54.91 54.55 3fga h ALA 41 Cb 0.44 0.08 0.18 0.00 0.00 0.00 0.00 17.79 18.49 3fga h ALA 41 CO 0.02 -0.60 0.20 -0.51 0.00 0.00 0.00 179.25 178.35 3fga s LEU 42 N -10.17 2.33 1.20 0.00 1.02 -0.44 -5.03 118.68 107.58 3fga s LEU 42 Ca -0.14 1.85 -0.18 0.00 0.02 0.00 0.00 54.13 55.68 3fga s LEU 42 Cb 0.06 -4.19 0.25 0.00 0.02 0.00 0.00 46.19 42.33 3fga s LEU 42 CO 0.65 -3.09 0.53 0.61 0.02 0.00 0.00 176.35 175.08 3fga n GLY 43 N -0.16 -2.95 0.24 -3.19 0.00 -1.26 -4.81 105.19 93.06 3fga n GLY 43 Ca 0.09 -1.15 -0.09 0.00 0.00 0.00 0.00 46.02 44.87 3fga n GLY 43 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3fga h VAL 44 N -2.97 1.29 0.00 1.61 2.07 -1.82 -3.10 116.25 113.32 3fga h VAL 44 Ca -0.36 -1.56 -0.20 0.00 0.82 0.00 0.00 66.70 65.41 3fga h VAL 44 Cb 1.06 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 32.29 3fga h VAL 44 CO 0.23 0.50 -1.03 1.05 0.02 0.00 0.00 177.57 178.34 3fga h GLU 45 N 0.55 0.00 -0.14 1.57 -0.00 -1.90 -2.50 114.58 112.17 3fga h GLU 45 Ca 0.05 0.00 -0.12 0.00 -0.00 0.00 0.00 59.36 59.28 3fga h GLU 45 Cb 0.91 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.65 3fga h GLU 45 CO 0.08 0.77 -0.46 0.00 -0.00 0.00 0.00 179.01 179.40 3fga h ARG 46 N 0.00 0.34 0.60 1.06 3.08 -1.92 0.32 114.38 117.86 3fga h ARG 46 Ca -0.06 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.79 3fga h ARG 46 Cb 1.71 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.76 3fga h ARG 46 CO 0.10 0.73 -0.46 1.15 -1.07 0.00 0.00 179.97 180.43 3fga h THR 47 N 0.27 0.09 0.18 2.04 2.02 -1.45 -1.32 112.91 114.74 3fga h THR 47 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 3fga h THR 47 Cb 0.91 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 3fga h THR 47 CO 0.08 0.00 -0.45 0.03 0.37 0.00 0.00 175.52 175.55 3fga h ARG 48 N -1.03 -0.67 -0.07 6.66 3.08 -1.38 -0.49 114.38 120.48 3fga h ARG 48 Ca -0.07 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3fga h ARG 48 Cb 0.86 0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.06 3fga h ARG 48 CO 0.02 -0.45 0.00 -1.13 -1.07 0.00 0.00 179.97 177.34 3fga n SER 49 N -5.01 1.72 0.01 7.04 3.41 0.09 -4.04 113.62 116.84 3fga n SER 49 Ca -0.08 -1.61 0.00 0.00 -0.26 0.00 0.00 58.87 56.92 3fga n SER 49 Cb 0.36 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.27 3fga n SER 49 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3fga n GLU 50 N 0.34 0.00 -0.07 4.33 4.07 -0.57 -4.78 120.64 123.96 3fga n GLU 50 Ca 0.18 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 57.16 3fga n GLU 50 Cb 0.37 -0.12 -0.05 0.00 -0.06 0.00 0.00 31.44 31.58 3fga n GLU 50 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 3fga h LEU 51 N 0.00 0.43 0.37 4.31 5.85 -0.81 -2.05 115.31 123.41 3fga h LEU 51 Ca 0.00 -0.40 -0.01 0.00 0.84 0.00 0.00 57.88 58.31 3fga h LEU 51 Cb 0.22 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 3fga h LEU 51 CO 0.00 0.73 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.48 3fga h LEU 52 N 0.13 -0.74 -1.19 2.25 -0.00 -1.25 -0.39 115.31 114.13 3fga h LEU 52 Ca 0.05 0.06 0.15 0.00 -0.00 0.00 0.00 57.88 58.13 3fga h LEU 52 Cb 0.56 0.24 -0.08 0.00 -0.00 0.00 0.00 40.66 41.38 3fga h LEU 52 CO 0.03 -0.43 0.60 -0.65 -0.00 0.00 0.00 178.44 177.99 3fga h PRO 53 N -0.65 0.74 -0.13 1.13 0.11 -1.73 -1.83 132.00 129.64 3fga h PRO 53 Ca -0.03 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.06 3fga h PRO 53 Cb 0.56 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.48 3fga h PRO 53 CO -0.01 0.49 -0.02 0.35 -0.21 0.00 0.00 178.00 178.60 3fga h PHE 54 N 0.76 -0.05 0.00 0.65 3.57 -0.58 -1.68 116.94 119.62 3fga h PHE 54 Ca 0.48 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.99 3fga h PHE 54 Cb 0.71 0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.49 3fga h PHE 54 CO -0.00 -0.04 0.00 1.28 -2.23 0.00 0.00 178.31 177.31 3fga n LEU 55 N -5.15 0.34 -0.03 0.59 4.77 -0.24 -1.34 117.00 115.95 3fga n LEU 55 Ca -0.04 0.60 -0.02 0.00 -0.03 0.00 0.00 56.01 56.52 3fga n LEU 55 Cb 0.09 -0.56 -0.01 0.00 -2.33 0.00 0.00 43.42 40.61 3fga n LEU 55 CO 0.28 -0.47 -0.13 0.74 -1.33 0.00 0.00 177.39 176.48 3fga h THR 56 N 0.00 0.00 0.27 -5.08 2.02 -0.60 -3.43 112.91 106.09 3fga h THR 56 Ca 0.00 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 3fga h THR 56 Cb 0.25 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.66 3fga h THR 56 CO 0.00 0.00 -0.13 0.44 0.37 0.00 0.00 175.52 176.20 3fga h ASP 57 N -0.39 -0.30 -0.42 4.18 3.32 -1.42 -3.40 116.42 118.00 3fga h ASP 57 Ca 0.00 0.01 -0.70 0.00 0.02 0.00 0.00 57.03 56.36 3fga h ASP 57 Cb 0.19 0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.78 3fga h ASP 57 CO 0.00 0.00 3.22 0.41 -1.72 0.00 0.00 179.24 181.16 3fga n THR 58 N -4.18 4.44 -3.23 0.35 -1.04 -0.45 -4.70 114.28 105.47 3fga n THR 58 Ca -0.04 -3.26 -0.02 0.00 -2.04 0.00 0.00 64.05 58.69 3fga n THR 58 Cb 0.14 -2.45 -0.04 0.00 -1.82 0.00 0.00 70.33 66.16 3fga n THR 58 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 3fga s ILE 59 N 1.31 -0.83 -0.11 12.58 -1.16 -1.25 -4.64 121.20 127.09 3fga s ILE 59 Ca 0.60 -0.06 0.02 0.00 -0.51 0.00 0.00 60.65 60.70 3fga s ILE 59 Cb 0.17 -0.94 0.01 0.00 0.61 0.00 0.00 42.46 42.31 3fga s ILE 59 CO -0.07 -0.08 -0.17 -0.31 -2.81 0.00 0.00 174.94 171.51 3fga s TYR 60 N 2.72 2.09 0.19 3.50 2.02 -1.26 -5.01 117.35 121.59 3fga s TYR 60 Ca 0.15 -0.95 -0.23 0.00 -0.37 0.00 0.00 57.07 55.68 3fga s TYR 60 Cb -0.14 -1.47 0.07 0.00 -0.40 0.00 0.00 41.96 40.02 3fga s TYR 60 CO -0.22 -0.46 1.01 0.34 -1.57 0.00 0.00 175.55 174.65 3fga s ASP 61 N 0.82 -0.04 0.71 2.29 -1.08 -1.26 -5.15 116.67 112.96 3fga s ASP 61 Ca -0.10 -0.63 -0.15 0.00 -0.52 0.00 0.00 52.55 51.15 3fga s ASP 61 Cb -0.16 0.51 0.03 0.00 -1.46 0.00 0.00 42.92 41.84 3fga s ASP 61 CO 0.01 -1.00 1.19 -1.61 0.52 0.00 0.00 175.17 174.28 3fga s GLU 62 N -2.46 2.30 0.41 4.34 2.02 -1.26 -4.80 118.70 119.25 3fga s GLU 62 Ca 0.19 1.71 0.12 0.00 0.02 0.00 0.00 54.97 57.01 3fga s GLU 62 Cb -0.02 -1.86 0.95 0.00 0.10 0.00 0.00 34.13 33.30 3fga s GLU 62 CO 0.05 -1.70 1.96 -0.44 0.02 0.00 0.00 175.26 175.15 3fga h ASP 63 N -0.15 0.46 -0.45 -0.19 3.32 -2.02 -1.54 116.42 115.84 3fga h ASP 63 Ca -0.48 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.52 3fga h ASP 63 Cb 1.29 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.73 3fga h ASP 63 CO 0.51 0.27 0.05 -0.08 -1.72 0.00 0.00 179.24 178.27 3fga h GLU 64 N 0.51 0.83 -0.15 3.56 4.81 -1.99 -1.09 114.58 121.06 3fga h GLU 64 Ca 0.31 -0.20 -0.13 0.00 -0.13 0.00 0.00 59.36 59.21 3fga h GLU 64 Cb 0.53 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.80 3fga h GLU 64 CO -0.10 0.80 -0.41 0.28 -0.73 0.00 0.00 179.01 178.85 3fga h VAL 65 N 0.78 1.35 -0.31 0.32 2.07 -1.66 -2.63 116.25 116.18 3fga h VAL 65 Ca 0.16 -1.68 0.02 0.00 0.82 0.00 0.00 66.70 66.02 3fga h VAL 65 Cb 0.40 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 3fga h VAL 65 CO 0.01 0.51 0.20 -0.07 0.02 0.00 0.00 177.57 178.25 3fga h LEU 66 N 0.18 0.29 -0.49 2.57 3.38 -1.31 -0.24 115.31 119.70 3fga h LEU 66 Ca -0.01 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 3fga h LEU 66 Cb 1.02 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 3fga h LEU 66 CO 0.09 0.21 -0.25 0.25 0.09 0.00 0.00 178.44 178.83 3fga h LEU 67 N 0.34 1.01 -0.25 1.67 7.12 -1.08 -1.54 115.31 122.58 3fga h LEU 67 Ca 0.12 -0.40 -0.12 0.00 0.13 0.00 0.00 57.88 57.61 3fga h LEU 67 Cb 0.07 -0.28 -0.00 0.00 -0.53 0.00 0.00 40.66 39.92 3fga h LEU 67 CO -0.03 1.20 -0.33 0.00 -0.13 0.00 0.00 178.44 179.15 3fga h ALA 68 N 0.87 0.38 -0.65 1.25 0.00 -0.88 -2.83 119.26 117.39 3fga h ALA 68 Ca 0.10 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3fga h ALA 68 Cb 0.83 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 3fga h ALA 68 CO 0.07 0.42 0.42 1.25 0.00 0.00 0.00 179.25 181.42 3fga h LEU 69 N 0.38 0.76 -0.37 0.00 5.85 -0.97 0.04 115.31 121.00 3fga h LEU 69 Ca 0.03 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.80 3fga h LEU 69 Cb 0.91 -0.19 -0.08 0.00 0.37 0.00 0.00 40.66 41.68 3fga h LEU 69 CO 0.08 0.56 -0.14 0.00 -0.34 0.00 0.00 178.44 178.60 3fga h ALA 70 N 1.23 0.17 -0.19 1.25 0.00 -1.29 -1.17 119.26 119.26 3fga h ALA 70 Ca 0.24 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 3fga h ALA 70 Cb -0.08 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3fga h ALA 70 CO -0.05 -0.51 0.11 1.49 0.00 0.00 0.00 179.25 180.29 3fga h GLU 71 N -0.07 0.26 -0.12 0.00 4.81 -1.02 -3.08 114.58 115.36 3fga h GLU 71 Ca 0.18 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.42 3fga h GLU 71 Cb 0.35 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 3fga h GLU 71 CO -0.42 0.23 -0.05 1.96 -0.73 0.00 0.00 179.01 179.99 3fga h GLN 72 N 0.21 -0.04 0.00 1.92 1.08 -0.65 -2.40 115.11 115.23 3fga h GLN 72 Ca 0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 3fga h GLN 72 Cb 0.04 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.48 3fga h GLN 72 CO -0.01 -0.03 0.00 -0.07 -0.95 0.00 0.00 178.83 177.77 3fga h LEU 73 N -0.04 0.00 0.00 1.46 3.38 -1.15 -1.28 115.31 117.68 3fga h LEU 73 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3fga h LEU 73 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3fga h LEU 73 CO -0.15 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.99 3fga n GLY 74 N -1.12 -0.88 0.17 0.83 0.00 -0.90 -3.52 105.19 99.76 3fga n GLY 74 Ca -0.03 -0.14 0.02 0.00 0.00 0.00 0.00 46.02 45.88 3fga n GLY 74 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fga n THR 75 N -1.12 0.54 1.06 2.61 -2.24 -0.48 -4.76 114.28 109.90 3fga n THR 75 Ca 0.15 -0.61 0.12 0.00 -2.27 0.00 0.00 64.05 61.44 3fga n THR 75 Cb 0.12 0.52 0.30 0.00 -2.10 0.00 0.00 70.33 69.18 3fga n THR 75 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3fga n PHE 76 N -0.36 0.14 -0.14 4.78 0.99 -1.23 -4.65 117.46 116.99 3fga n PHE 76 Ca 0.03 -0.07 -0.04 0.00 -0.00 0.00 0.00 57.45 57.37 3fga n PHE 76 Cb 0.54 0.00 0.02 0.00 -1.00 0.00 0.00 39.48 39.04 3fga n PHE 76 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 3fga h THR 77 N 3.48 0.55 -0.57 4.37 2.02 -1.89 0.34 112.91 121.20 3fga h THR 77 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 3fga h THR 77 Cb 0.75 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 3fga h THR 77 CO 0.00 0.00 0.11 0.74 0.37 0.00 0.00 175.52 176.74 3fga h THR 78 N -0.01 1.24 0.00 3.16 2.02 -1.90 0.55 112.91 117.98 3fga h THR 78 Ca 0.21 -0.90 -0.03 0.00 0.77 0.00 0.00 66.41 66.46 3fga h THR 78 Cb 0.33 0.68 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 3fga h THR 78 CO -0.46 0.34 -0.15 -0.07 0.37 0.00 0.00 175.52 175.55 3fga h LEU 79 N 0.86 0.00 -0.64 2.58 3.38 -1.28 -1.85 115.31 118.36 3fga h LEU 79 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3fga h LEU 79 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3fga h LEU 79 CO 0.00 0.15 -0.64 0.55 0.09 0.00 0.00 178.44 178.60 3fga n VAL 80 N -3.48 0.00 0.00 1.22 3.14 -0.72 -4.55 118.33 113.94 3fga n VAL 80 Ca -0.01 -0.17 0.00 0.00 -2.96 0.00 0.00 64.34 61.20 3fga n VAL 80 Cb 0.31 1.12 0.00 0.00 -1.06 0.00 0.00 33.84 34.21 3fga n VAL 80 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3fga n GLY 81 N 1.44 1.51 1.03 7.55 0.00 -0.70 -4.74 105.19 111.29 3fga n GLY 81 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3fga n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fga n GLY 82 N -0.07 -2.56 0.57 -0.02 0.00 0.19 -4.48 105.19 98.81 3fga n GLY 82 Ca 0.00 -1.63 0.40 0.00 0.00 0.00 0.00 46.02 44.79 3fga n GLY 82 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3fga h PRO 83 N 0.00 0.05 0.00 1.61 0.11 -1.82 0.48 132.00 132.43 3fga h PRO 83 Ca 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3fga h PRO 83 Cb 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.10 3fga h PRO 83 CO 0.00 0.03 0.07 1.49 -0.21 0.00 0.00 178.00 179.38 3fga h GLU 84 N 0.05 0.00 0.00 1.05 4.81 -1.87 -3.22 114.58 115.41 3fga h GLU 84 Ca 0.73 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.96 3fga h GLU 84 Cb 2.74 0.00 0.00 0.00 0.63 0.00 0.00 28.75 32.12 3fga h GLU 84 CO -0.11 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 178.83 3fga n TYR 85 N -2.32 0.00 -0.27 0.92 4.01 0.17 -4.85 117.16 114.81 3fga n TYR 85 Ca -0.02 -0.01 0.33 0.00 -0.16 0.00 0.00 57.90 58.05 3fga n TYR 85 Cb 0.10 -0.00 0.72 0.00 -0.31 0.00 0.00 39.34 39.85 3fga n TYR 85 CO 0.00 0.00 0.00 -0.39 -0.46 0.00 0.00 176.86 176.01 3fga h VAL 86 N 0.91 0.32 0.00 -0.72 -1.51 -1.53 -1.60 116.25 112.12 3fga h VAL 86 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.46 3fga h VAL 86 Cb 0.43 0.36 -0.00 0.00 -2.13 0.00 0.00 31.29 29.96 3fga h VAL 86 CO 0.00 0.00 -0.03 1.12 -1.23 0.00 0.00 177.57 177.43 3fga h HIS 87 N 0.00 0.00 -0.87 5.19 2.07 -1.88 -0.82 115.15 118.84 3fga h HIS 87 Ca 0.53 0.00 0.20 0.00 -2.85 0.00 0.00 60.37 58.25 3fga h HIS 87 Cb 2.28 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 32.20 3fga h HIS 87 CO 0.00 0.03 0.58 0.00 -3.07 0.00 0.00 177.93 175.47 3fga h LEU 89 N 0.36 0.00 -0.31 0.00 3.38 -1.36 -3.35 115.31 114.02 3fga h LEU 89 Ca 0.45 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.34 3fga h LEU 89 Cb 1.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 3fga h LEU 89 CO -0.15 0.00 -0.10 -0.07 0.09 0.00 0.00 178.44 178.21 3fga h LEU 90 N 0.00 0.63 -0.04 1.67 3.38 -1.47 -3.04 115.31 116.45 3fga h LEU 90 Ca 0.00 -0.38 0.04 0.00 0.09 0.00 0.00 57.88 57.63 3fga h LEU 90 Cb 0.61 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 3fga h LEU 90 CO 0.00 0.87 -0.34 -0.65 0.09 0.00 0.00 178.44 178.41 3fga h PRO 91 N 0.39 -0.45 -0.54 1.13 0.11 -1.75 0.11 132.00 131.00 3fga h PRO 91 Ca 0.08 0.03 0.11 0.00 0.11 0.00 0.00 66.00 66.32 3fga h PRO 91 Cb 0.60 0.10 -0.11 0.00 0.11 0.00 0.00 31.00 31.71 3fga h PRO 91 CO 0.04 -0.30 -0.21 -1.35 -0.21 0.00 0.00 178.00 175.97 3fga h PRO 92 N -0.47 -0.08 0.00 1.05 0.11 -1.82 -1.87 132.00 128.94 3fga h PRO 92 Ca 0.07 0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.14 3fga h PRO 92 Cb 0.57 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.69 3fga h PRO 92 CO -0.30 -0.05 -0.21 -0.07 -0.21 0.00 0.00 178.00 177.16 3fga h LEU 93 N -0.08 0.00 -0.46 2.35 3.38 -1.26 -2.41 115.31 116.83 3fga h LEU 93 Ca 0.25 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.15 3fga h LEU 93 Cb 0.47 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3fga h LEU 93 CO -0.60 0.21 -0.01 -0.08 0.09 0.00 0.00 178.44 178.06 3fga h GLU 94 N 0.00 0.82 0.04 1.13 4.81 0.04 -1.87 114.58 119.55 3fga h GLU 94 Ca -0.00 -0.27 -0.00 0.00 -0.13 0.00 0.00 59.36 58.96 3fga h GLU 94 Cb 0.43 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 3fga h GLU 94 CO 0.03 0.88 -0.03 0.77 -0.73 0.00 0.00 179.01 179.93 3fga h SER 95 N 0.67 -0.07 0.22 1.04 0.02 -1.23 -2.64 113.55 111.55 3fga h SER 95 Ca 0.13 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 3fga h SER 95 Cb 0.51 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.07 3fga h SER 95 CO 0.03 -0.05 -0.07 -0.07 -1.14 0.00 0.00 176.83 175.53 3fga h LEU 96 N -0.07 0.00 -0.46 5.07 3.38 -1.38 -0.02 115.31 121.83 3fga h LEU 96 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3fga h LEU 96 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3fga h LEU 96 CO 0.00 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.60 3fga h ALA 97 N 1.93 1.00 0.00 1.53 0.00 -0.97 -3.11 119.26 119.64 3fga h ALA 97 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 3fga h ALA 97 Cb 0.20 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3fga h ALA 97 CO 0.01 0.00 -1.50 2.41 0.00 0.00 0.00 179.25 180.17 3fga n THR 98 N -2.52 0.75 -1.58 0.00 -1.04 -0.04 -4.17 114.28 105.68 3fga n THR 98 Ca 0.03 -0.62 -0.48 0.00 -2.04 0.00 0.00 64.05 60.95 3fga n THR 98 Cb 0.36 -0.41 -0.03 0.00 -1.82 0.00 0.00 70.33 68.43 3fga n THR 98 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 3fga n VAL 99 N -2.66 1.17 -0.10 12.58 0.31 -1.11 -4.46 118.33 124.06 3fga n VAL 99 Ca -0.07 -0.29 -0.06 0.00 -0.01 0.00 0.00 64.34 63.90 3fga n VAL 99 Cb 0.71 -0.90 0.01 0.00 -0.91 0.00 0.00 33.84 32.75 3fga n VAL 99 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3fga h GLU 100 N 3.05 0.23 -6.33 5.55 5.08 -1.93 -3.42 114.58 116.80 3fga h GLU 100 Ca -0.42 -0.01 -0.54 0.00 -1.00 0.00 0.00 59.36 57.39 3fga h GLU 100 Cb 1.34 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.55 3fga h GLU 100 CO 0.68 0.15 1.10 -2.00 -1.00 0.00 0.00 179.01 177.94 3fga s GLU 101 N -6.16 4.18 0.32 2.33 2.56 -1.26 -4.87 118.70 115.79 3fga s GLU 101 Ca -0.13 2.33 0.09 0.00 0.00 0.00 0.00 54.97 57.26 3fga s GLU 101 Cb 0.12 -3.94 0.89 0.00 2.00 0.00 0.00 34.13 33.20 3fga s GLU 101 CO 0.71 -0.85 1.72 1.15 -0.56 0.00 0.00 175.26 177.43 3fga h THR 102 N 5.41 0.50 0.00 -1.70 2.02 -2.01 -1.82 112.91 115.31 3fga h THR 102 Ca -0.43 -0.18 -0.11 0.00 0.77 0.00 0.00 66.41 66.46 3fga h THR 102 Cb 1.20 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 3fga h THR 102 CO 0.94 0.10 -0.54 1.62 0.37 0.00 0.00 175.52 178.01 3fga h VAL 103 N 0.52 0.99 0.06 3.16 3.04 -1.95 -2.01 116.25 120.07 3fga h VAL 103 Ca 0.65 -2.20 -0.10 0.00 -1.01 0.00 0.00 66.70 64.03 3fga h VAL 103 Cb 1.26 2.35 0.01 0.00 -2.01 0.00 0.00 31.29 32.90 3fga h VAL 103 CO -0.50 0.53 -0.44 0.58 -1.01 0.00 0.00 177.57 176.72 3fga h VAL 104 N 0.00 1.60 0.00 1.51 2.07 -1.69 -2.85 116.25 116.89 3fga h VAL 104 Ca -0.01 -2.34 -0.10 0.00 0.82 0.00 0.00 66.70 65.08 3fga h VAL 104 Cb 1.31 3.15 -0.01 0.00 -1.52 0.00 0.00 31.29 34.21 3fga h VAL 104 CO 0.07 0.64 -0.45 0.08 0.02 0.00 0.00 177.57 177.93 3fga h ARG 105 N -0.57 0.00 -0.45 1.57 0.11 -1.52 -2.06 114.38 111.46 3fga h ARG 105 Ca -0.07 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 59.97 3fga h ARG 105 Cb 1.31 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.37 3fga h ARG 105 CO 0.08 0.45 0.12 -0.44 0.10 0.00 0.00 179.97 180.29 3fga h ASP 106 N 0.00 0.67 -0.61 0.08 5.19 -1.42 -0.75 116.42 119.58 3fga h ASP 106 Ca -0.00 -0.22 0.01 0.00 -0.62 0.00 0.00 57.03 56.19 3fga h ASP 106 Cb 0.80 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 40.11 3fga h ASP 106 CO 0.06 0.72 0.40 0.11 -3.12 0.00 0.00 179.24 177.41 3fga h LYS 107 N 0.59 0.79 -0.50 3.56 1.79 -1.26 -1.27 116.57 120.26 3fga h LYS 107 Ca 0.14 -0.05 0.08 0.00 -2.18 0.00 0.00 60.65 58.64 3fga h LYS 107 Cb 0.30 -0.18 -0.06 0.00 -1.58 0.00 0.00 32.23 30.71 3fga h LYS 107 CO -0.00 0.52 0.14 0.00 -1.08 0.00 0.00 179.45 179.03 3fga h ALA 108 N 1.23 0.59 -0.08 3.86 0.00 -1.03 0.18 119.26 124.01 3fga h ALA 108 Ca 0.23 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 3fga h ALA 108 Cb -0.08 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3fga h ALA 108 CO -0.06 -0.27 0.04 0.28 0.00 0.00 0.00 179.25 179.25 3fga h VAL 109 N 0.29 1.10 -0.74 0.00 2.07 -0.90 -0.28 116.25 117.80 3fga h VAL 109 Ca 0.25 -0.29 0.11 0.00 0.82 0.00 0.00 66.70 67.59 3fga h VAL 109 Cb 0.30 1.16 -0.08 0.00 -1.52 0.00 0.00 31.29 31.15 3fga h VAL 109 CO -0.29 0.09 0.34 -0.08 0.02 0.00 0.00 177.57 177.65 3fga h GLU 110 N 0.01 0.54 -0.31 1.57 4.81 -0.50 0.11 114.58 120.81 3fga h GLU 110 Ca 0.03 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.11 3fga h GLU 110 Cb 0.11 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 3fga h GLU 110 CO -0.00 0.35 -0.28 0.77 -0.73 0.00 0.00 179.01 179.12 3fga h SER 111 N 0.55 0.64 -0.07 1.04 0.02 -0.44 -1.95 113.55 113.35 3fga h SER 111 Ca 0.38 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 3fga h SER 111 Cb 0.48 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.84 3fga h SER 111 CO -0.32 0.89 -0.03 -0.07 -1.14 0.00 0.00 176.83 176.16 3fga h LEU 112 N 0.54 0.16 -0.18 5.07 3.38 0.47 -2.41 115.31 122.34 3fga h LEU 112 Ca 0.07 -0.40 0.05 0.00 0.09 0.00 0.00 57.88 57.69 3fga h LEU 112 Cb 0.76 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.41 3fga h LEU 112 CO 0.06 0.52 -0.19 0.03 0.09 0.00 0.00 178.44 178.96 3fga h ARG 113 N -0.21 -0.20 -0.20 1.13 3.08 -0.83 -1.84 114.38 115.31 3fga h ARG 113 Ca 0.02 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.13 3fga h ARG 113 Cb 0.46 0.05 -0.07 0.00 0.08 0.00 0.00 29.97 30.49 3fga h ARG 113 CO 0.01 -0.14 -0.43 0.00 -1.07 0.00 0.00 179.97 178.34 3fga h ALA 114 N 0.85 -0.57 0.00 0.04 0.00 -1.30 -2.34 119.26 115.94 3fga h ALA 114 Ca 0.12 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3fga h ALA 114 Cb 0.38 0.83 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3fga h ALA 114 CO -0.31 -0.92 0.00 0.44 0.00 0.00 0.00 179.25 178.46 3fga n ILE 115 N -5.43 0.76 -0.32 0.00 -5.35 -0.91 -2.98 119.36 105.12 3fga n ILE 115 Ca -0.03 0.08 -0.01 0.00 -0.27 0.00 0.00 62.75 62.51 3fga n ILE 115 Cb 0.36 -0.99 0.11 0.00 -1.74 0.00 0.00 39.64 37.38 3fga n ILE 115 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 3fga h SER 116 N 0.00 0.96 -0.11 7.28 4.64 -0.76 -0.75 113.55 124.81 3fga h SER 116 Ca 0.00 -0.01 0.03 0.00 -0.47 0.00 0.00 61.79 61.34 3fga h SER 116 Cb 0.48 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3fga h SER 116 CO 0.00 0.66 0.23 0.45 -0.87 0.00 0.00 176.83 177.30 3fga h HIS 117 N 1.12 0.00 -0.00 4.77 3.86 -1.65 0.31 115.15 123.56 3fga h HIS 117 Ca 0.35 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.56 3fga h HIS 117 Cb -0.01 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3fga h HIS 117 CO -0.02 0.00 -0.12 0.39 0.86 0.00 0.00 177.93 179.04 3fga n GLU 118 N -3.37 0.25 -2.90 2.45 -0.58 -0.29 -4.84 120.64 111.37 3fga n GLU 118 Ca 0.00 -0.06 -0.41 0.00 -0.42 0.00 0.00 57.16 56.27 3fga n GLU 118 Cb 0.32 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.65 3fga n GLU 118 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 3fga s HIS 119 N -2.79 3.55 0.59 -0.32 3.76 0.11 -4.63 115.29 115.56 3fga s HIS 119 Ca 0.20 1.38 -0.20 0.00 -0.15 0.00 0.00 55.06 56.29 3fga s HIS 119 Cb 0.19 -2.96 -0.03 0.00 1.11 0.00 0.00 32.58 30.88 3fga s HIS 119 CO 0.54 -0.05 1.25 -1.13 -0.85 0.00 0.00 174.74 174.50 3fga n SER 120 N 4.29 2.05 -0.36 1.40 3.41 -1.26 -4.71 113.62 118.44 3fga n SER 120 Ca 0.03 0.89 0.30 0.00 -0.26 0.00 0.00 58.87 59.83 3fga n SER 120 Cb 0.50 -1.53 0.62 0.00 -0.26 0.00 0.00 64.21 63.54 3fga n SER 120 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3fga h PRO 121 N 0.90 0.20 -0.15 4.33 0.11 -1.97 0.13 132.00 135.55 3fga h PRO 121 Ca -0.50 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 3fga h PRO 121 Cb 1.33 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 3fga h PRO 121 CO 0.54 0.13 0.05 0.77 -0.21 0.00 0.00 178.00 179.28 3fga h SER 122 N 0.20 0.22 -0.62 -2.05 0.02 -1.90 -1.49 113.55 107.92 3fga h SER 122 Ca 0.64 -0.20 -0.08 0.00 -0.84 0.00 0.00 61.79 61.31 3fga h SER 122 Cb 2.01 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 64.47 3fga h SER 122 CO -0.22 0.36 0.06 0.44 -1.14 0.00 0.00 176.83 176.32 3fga h ASP 123 N 0.07 1.03 -0.93 3.07 3.32 -1.22 0.17 116.42 121.94 3fga h ASP 123 Ca 0.05 -0.28 0.14 0.00 0.02 0.00 0.00 57.03 56.95 3fga h ASP 123 Cb 0.22 -0.27 -0.08 0.00 0.22 0.00 0.00 39.33 39.42 3fga h ASP 123 CO -0.00 1.05 0.59 0.25 -1.72 0.00 0.00 179.24 179.41 3fga h LEU 124 N 0.97 0.74 0.15 1.55 5.85 -0.82 0.12 115.31 123.87 3fga h LEU 124 Ca 0.18 0.04 -0.29 0.00 0.84 0.00 0.00 57.88 58.66 3fga h LEU 124 Cb 0.49 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 41.43 3fga h LEU 124 CO 0.02 0.38 -1.28 -0.33 -0.34 0.00 0.00 178.44 176.89 3fga h GLU 125 N 0.79 0.32 0.00 1.25 5.08 -0.06 0.27 114.58 122.24 3fga h GLU 125 Ca 0.46 -0.55 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3fga h GLU 125 Cb 0.64 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.10 3fga h GLU 125 CO -0.23 1.26 -0.90 0.00 -1.00 0.00 0.00 179.01 178.14 3fga n ALA 126 N -2.57 2.96 0.12 3.43 0.00 0.47 -4.46 120.51 120.45 3fga n ALA 126 Ca -0.10 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.04 3fga n ALA 126 Cb 1.04 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 19.41 3fga n ALA 126 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3fga n HIS 127 N -2.23 -1.90 0.20 0.00 8.25 0.37 -4.81 115.22 115.10 3fga n HIS 127 Ca 0.02 0.34 -0.15 0.00 -0.26 0.00 0.00 57.72 57.67 3fga n HIS 127 Cb 0.47 0.44 -0.08 0.00 1.12 0.00 0.00 29.99 31.95 3fga n HIS 127 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3fga h PHE 128 N 0.00 -0.42 -0.33 4.41 3.57 -1.45 -2.70 116.94 120.02 3fga h PHE 128 Ca 0.00 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.52 3fga h PHE 128 Cb 0.00 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.85 3fga h PHE 128 CO 0.00 -0.20 0.15 0.28 -2.23 0.00 0.00 178.31 176.31 3fga h VAL 129 N -0.55 0.96 -0.87 1.41 2.07 -0.69 -1.70 116.25 116.88 3fga h VAL 129 Ca -0.05 -0.11 0.17 0.00 0.82 0.00 0.00 66.70 67.53 3fga h VAL 129 Cb 0.41 0.61 -0.10 0.00 -1.52 0.00 0.00 31.29 30.69 3fga h VAL 129 CO 0.08 0.06 0.44 -0.65 0.02 0.00 0.00 177.57 177.51 3fga h PRO 130 N 0.31 0.57 -0.51 1.57 0.11 -1.77 -0.24 132.00 132.03 3fga h PRO 130 Ca 0.14 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 66.31 3fga h PRO 130 Cb 0.08 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 30.99 3fga h PRO 130 CO -0.12 0.37 0.09 1.25 -0.21 0.00 0.00 178.00 179.39 3fga h LEU 131 N 0.58 -0.03 -0.77 2.35 7.12 -0.99 -0.17 115.31 123.40 3fga h LEU 131 Ca 0.49 0.10 -0.02 0.00 0.13 0.00 0.00 57.88 58.58 3fga h LEU 131 Cb 0.76 0.14 -0.04 0.00 -0.53 0.00 0.00 40.66 40.99 3fga h LEU 131 CO -0.40 0.01 0.40 0.58 -0.13 0.00 0.00 178.44 178.90 3fga h VAL 132 N 0.22 1.24 -0.01 1.05 2.07 -0.37 -1.36 116.25 119.10 3fga h VAL 132 Ca 0.26 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 67.16 3fga h VAL 132 Cb 0.36 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 3fga h VAL 132 CO -0.35 0.27 -0.03 0.11 0.02 0.00 0.00 177.57 177.59 3fga h LYS 133 N 1.07 -0.05 -0.03 1.57 1.57 -0.40 0.15 116.57 120.45 3fga h LYS 133 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3fga h LYS 133 Cb 0.07 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 3fga h LYS 133 CO -0.04 -0.03 0.02 0.00 -0.57 0.00 0.00 179.45 178.83 3fga h ARG 134 N -0.05 0.04 -0.54 3.15 3.08 -0.85 0.11 114.38 119.31 3fga h ARG 134 Ca 0.02 -0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.10 3fga h ARG 134 Cb 0.07 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.07 3fga h ARG 134 CO -0.04 0.05 0.30 -0.07 -1.07 0.00 0.00 179.97 179.13 3fga h LEU 135 N 0.03 0.45 -1.16 3.04 3.38 -1.19 -0.72 115.31 119.14 3fga h LEU 135 Ca 0.01 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3fga h LEU 135 Cb 0.01 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3fga h LEU 135 CO -0.00 0.31 -0.17 0.00 0.09 0.00 0.00 178.44 178.66 3fga h ALA 136 N 1.27 1.02 -0.43 1.53 0.00 -0.13 -2.89 119.26 119.63 3fga h ALA 136 Ca 0.23 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3fga h ALA 136 Cb 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3fga h ALA 136 CO -0.14 0.22 0.00 0.41 0.00 0.00 0.00 179.25 179.73 3fga n GLY 137 N 0.14 2.99 3.71 0.00 0.00 -0.03 -4.77 105.19 107.24 3fga n GLY 137 Ca 0.00 -0.65 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 3fga n GLY 137 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3fga s GLY 138 N -1.17 1.66 0.35 -0.02 0.00 -0.32 -4.96 107.32 102.86 3fga s GLY 138 Ca 0.35 0.26 0.04 0.00 0.00 0.00 0.00 44.72 45.38 3fga s GLY 138 CO 0.18 0.68 1.91 -0.55 0.00 0.00 0.00 173.10 175.32 3fga h ASP 139 N -1.52 0.52 -3.26 1.64 3.32 -1.91 -3.45 116.42 111.76 3fga h ASP 139 Ca -0.46 -0.08 -0.64 0.00 0.02 0.00 0.00 57.03 55.87 3fga h ASP 139 Cb 1.26 -0.13 -0.13 0.00 0.22 0.00 0.00 39.33 40.55 3fga h ASP 139 CO 0.49 0.54 -0.68 0.26 -1.72 0.00 0.00 179.24 178.13 3fga s TRP 140 N -5.10 2.89 0.27 4.55 0.51 -1.26 -5.02 118.94 115.77 3fga s TRP 140 Ca -0.08 -0.09 0.37 0.00 -2.12 0.00 0.00 56.10 54.18 3fga s TRP 140 Cb 0.16 -1.47 1.77 0.00 -0.81 0.00 0.00 33.47 33.12 3fga s TRP 140 CO 0.76 0.48 2.10 0.27 -0.51 0.00 0.00 176.95 180.05 3fga h PHE 141 N 3.25 0.00 -0.09 -1.98 -5.15 -1.98 -2.79 116.94 108.20 3fga h PHE 141 Ca -0.48 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.25 3fga h PHE 141 Cb 1.18 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.34 3fga h PHE 141 CO 0.61 0.00 -0.09 1.79 -2.00 0.00 0.00 178.31 178.62 3fga h THR 142 N 0.00 1.36 -0.46 0.88 1.35 -1.92 -0.35 112.91 113.76 3fga h THR 142 Ca 0.00 -1.24 0.04 0.00 -0.55 0.00 0.00 66.41 64.66 3fga h THR 142 Cb 0.25 1.98 -0.04 0.00 -1.73 0.00 0.00 68.15 68.61 3fga h THR 142 CO 0.00 0.35 0.23 0.28 -0.25 0.00 0.00 175.52 176.13 3fga h SER 143 N -0.19 0.32 -0.47 5.36 0.02 -1.66 -1.89 113.55 115.05 3fga h SER 143 Ca 0.02 0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 3fga h SER 143 Cb 0.60 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.09 3fga h SER 143 CO 0.02 0.23 0.00 0.03 -1.14 0.00 0.00 176.83 175.97 3fga h ARG 144 N 0.45 0.83 -0.40 3.45 3.08 -1.42 -2.13 114.38 118.25 3fga h ARG 144 Ca 0.20 -0.26 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 3fga h ARG 144 Cb 0.12 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3fga h ARG 144 CO -0.15 0.88 -0.02 1.79 -1.07 0.00 0.00 179.97 181.40 3fga h THR 145 N 0.68 1.23 -0.73 2.04 1.35 -0.90 -2.27 112.91 114.30 3fga h THR 145 Ca 0.13 -0.93 -0.03 0.00 -0.55 0.00 0.00 66.41 65.04 3fga h THR 145 Cb 0.50 0.95 -0.03 0.00 -1.73 0.00 0.00 68.15 67.84 3fga h THR 145 CO 0.02 0.32 0.35 0.28 -0.25 0.00 0.00 175.52 176.25 3fga h SER 146 N 0.61 0.95 -1.00 5.36 0.02 -1.10 -2.93 113.55 115.46 3fga h SER 146 Ca 0.12 -0.13 0.09 0.00 -0.84 0.00 0.00 61.79 61.03 3fga h SER 146 Cb 0.41 -0.24 -0.08 0.00 0.14 0.00 0.00 62.40 62.64 3fga h SER 146 CO 0.02 0.81 0.63 0.00 -1.14 0.00 0.00 176.83 177.15 3fga h ALA 147 N 1.18 1.44 -0.40 3.77 0.00 -0.79 -2.25 119.26 122.20 3fga h ALA 147 Ca 0.25 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.28 3fga h ALA 147 Cb 0.11 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3fga h ALA 147 CO -0.03 0.33 0.43 0.00 0.00 0.00 0.00 179.25 179.98 3fga n GLY 149 N -1.49 -0.91 0.00 0.00 0.00 -0.85 -4.21 105.19 97.74 3fga n GLY 149 Ca 0.07 -0.25 0.05 0.00 0.00 0.00 0.00 46.02 45.89 3fga n GLY 149 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fga n LEU 150 N -0.89 0.25 -0.05 0.99 4.77 -0.18 -4.69 117.00 117.19 3fga n LEU 150 Ca 0.17 -0.28 -0.11 0.00 -0.03 0.00 0.00 56.01 55.76 3fga n LEU 150 Cb 0.24 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.28 3fga n LEU 150 CO 0.21 0.06 0.84 -0.26 -1.33 0.00 0.00 177.39 176.92 3fga h PHE 151 N 0.00 0.29 0.00 -1.77 -1.00 -1.73 -3.19 116.94 109.54 3fga h PHE 151 Ca 0.00 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.75 3fga h PHE 151 Cb 0.31 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 39.79 3fga h PHE 151 CO 0.00 0.36 0.00 -1.13 -1.61 0.00 0.00 178.31 175.93 3fga n SER 152 N -4.83 0.00 -0.03 2.17 3.41 -1.26 -2.15 113.62 110.93 3fga n SER 152 Ca -0.04 -1.04 0.03 0.00 -0.26 0.00 0.00 58.87 57.56 3fga n SER 152 Cb 0.14 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.95 3fga n SER 152 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3fga n VAL 153 N -0.87 0.38 -0.08 -3.33 0.24 -1.21 -4.59 118.33 108.87 3fga n VAL 153 Ca 0.15 -0.52 -0.12 0.00 -2.04 0.00 0.00 64.34 61.81 3fga n VAL 153 Cb 0.07 -0.12 -0.15 0.00 -1.47 0.00 0.00 33.84 32.17 3fga n VAL 153 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3fga h TYR 155 N 0.01 -0.63 0.00 0.00 3.20 -1.68 -2.32 116.97 115.54 3fga h TYR 155 Ca -0.49 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.42 3fga h TYR 155 Cb 2.11 0.32 0.00 0.00 1.54 0.00 0.00 36.73 40.70 3fga h TYR 155 CO 0.01 -0.31 0.00 -2.30 -1.64 0.00 0.00 178.16 173.92 3fga n PRO 156 N -5.37 0.15 -0.12 1.82 -0.02 -1.26 -2.71 135.00 127.49 3fga n PRO 156 Ca -0.01 0.54 0.04 0.00 -2.02 0.00 0.00 63.50 62.05 3fga n PRO 156 Cb 0.29 -1.89 0.10 0.00 -0.02 0.00 0.00 33.50 31.98 3fga n PRO 156 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3fga n ARG 157 N -2.20 2.85 -4.22 -0.52 1.74 -0.88 -5.02 116.66 108.41 3fga n ARG 157 Ca 0.00 -1.85 -0.24 0.00 -0.77 0.00 0.00 57.85 54.98 3fga n ARG 157 Cb 0.12 -1.18 -0.08 0.00 -1.02 0.00 0.00 32.46 30.30 3fga n ARG 157 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3fga s VAL 158 N -0.99 2.58 0.76 1.55 -7.23 -1.10 -4.61 120.40 111.35 3fga s VAL 158 Ca 0.16 -1.81 -0.12 0.00 -1.81 0.00 0.00 61.98 58.40 3fga s VAL 158 Cb 0.08 -2.92 0.05 0.00 0.56 0.00 0.00 36.38 34.15 3fga s VAL 158 CO 0.11 -0.11 1.10 -0.94 -0.31 0.00 0.00 175.10 174.95 3fga s SER 159 N -3.81 4.51 0.33 4.85 1.04 -1.26 -4.73 113.70 114.62 3fga s SER 159 Ca 0.38 1.91 0.02 0.00 0.48 0.00 0.00 55.95 58.73 3fga s SER 159 Cb 0.01 -2.53 0.57 0.00 0.10 0.00 0.00 66.02 64.17 3fga s SER 159 CO 0.21 -2.03 1.93 0.77 0.98 0.00 0.00 173.24 175.10 3fga h SER 160 N -0.90 0.68 -0.22 7.02 4.64 -1.98 0.12 113.55 122.90 3fga h SER 160 Ca -0.44 -0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3fga h SER 160 Cb 1.24 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 63.15 3fga h SER 160 CO 0.51 0.59 0.13 0.00 -0.87 0.00 0.00 176.83 177.20 3fga h ALA 161 N 1.51 0.28 -0.93 5.18 0.00 -1.99 0.29 119.26 123.60 3fga h ALA 161 Ca 0.18 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.06 3fga h ALA 161 Cb 0.11 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 3fga h ALA 161 CO -0.02 -0.21 0.61 0.28 0.00 0.00 0.00 179.25 179.90 3fga h VAL 162 N 0.27 1.24 -0.34 0.00 2.07 -1.74 -2.17 116.25 115.58 3fga h VAL 162 Ca 0.08 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 3fga h VAL 162 Cb 0.02 -0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 29.65 3fga h VAL 162 CO -0.02 0.23 0.21 0.11 0.02 0.00 0.00 177.57 178.13 3fga h LYS 163 N 1.26 0.45 0.00 1.57 1.57 -0.24 -0.86 116.57 120.32 3fga h LYS 163 Ca 0.34 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.98 3fga h LYS 163 Cb -0.14 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 3fga h LYS 163 CO -0.07 0.31 -0.49 0.00 -0.57 0.00 0.00 179.45 178.63 3fga h ALA 164 N 1.77 1.13 -0.00 3.86 0.00 -0.33 -2.48 119.26 123.21 3fga h ALA 164 Ca 0.12 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 3fga h ALA 164 Cb -0.03 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.69 3fga h ALA 164 CO -0.02 0.61 -0.35 0.93 0.00 0.00 0.00 179.25 180.42 3fga h GLU 165 N 0.00 0.24 -0.66 0.00 5.08 -0.88 -2.79 114.58 115.56 3fga h GLU 165 Ca -0.00 -0.26 0.07 0.00 -1.00 0.00 0.00 59.36 58.17 3fga h GLU 165 Cb 0.90 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.18 3fga h GLU 165 CO 0.06 0.97 0.44 -0.07 -1.00 0.00 0.00 179.01 179.42 3fga h LEU 166 N -0.39 0.55 -0.40 1.33 3.38 -1.19 -0.61 115.31 117.98 3fga h LEU 166 Ca -0.04 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 3fga h LEU 166 Cb 1.10 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 3fga h LEU 166 CO 0.07 0.35 -0.34 0.03 0.09 0.00 0.00 178.44 178.64 3fga h ARG 167 N 0.63 0.94 0.18 1.13 3.08 -1.45 -0.64 114.38 118.25 3fga h ARG 167 Ca 0.29 -0.48 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 3fga h ARG 167 Cb 0.34 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.39 3fga h ARG 167 CO -0.09 1.14 -0.09 0.37 -1.07 0.00 0.00 179.97 180.22 3fga h GLN 168 N 0.77 -0.24 -0.62 0.04 -0.00 -0.91 -1.08 115.11 113.08 3fga h GLN 168 Ca 0.07 0.02 0.05 0.00 -0.00 0.00 0.00 58.65 58.79 3fga h GLN 168 Cb 0.94 0.05 -0.05 0.00 0.00 0.00 0.00 27.48 28.42 3fga h GLN 168 CO 0.09 -0.05 0.34 1.88 0.00 0.00 0.00 178.83 181.09 3fga h TYR 169 N -0.38 0.62 -0.57 3.99 -1.99 -1.13 -0.17 116.97 117.33 3fga h TYR 169 Ca -0.02 0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.74 3fga h TYR 169 Cb 0.30 -0.19 -0.03 0.00 2.00 0.00 0.00 36.73 38.81 3fga h TYR 169 CO -0.02 0.31 0.38 0.35 -0.00 0.00 0.00 178.16 179.17 3fga h PHE 170 N 0.64 0.71 -0.34 4.88 3.57 -0.90 -0.85 116.94 124.64 3fga h PHE 170 Ca 0.27 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.70 3fga h PHE 170 Cb 0.15 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 3fga h PHE 170 CO -0.08 0.44 -0.15 -0.09 -2.23 0.00 0.00 178.31 176.20 3fga h ARG 171 N 0.76 0.61 -0.25 1.11 2.43 0.24 -2.28 114.38 117.01 3fga h ARG 171 Ca 0.21 -0.20 -0.16 0.00 -0.81 0.00 0.00 59.98 59.03 3fga h ARG 171 Cb -0.05 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 3fga h ARG 171 CO -0.05 0.74 -0.48 -0.91 -1.51 0.00 0.00 179.97 177.76 3fga h ASN 172 N 0.56 0.72 -0.39 -3.80 -0.26 0.23 -2.99 115.58 109.65 3fga h ASN 172 Ca 0.10 -0.35 -0.03 0.00 -0.56 0.00 0.00 56.30 55.45 3fga h ASN 172 Cb 0.57 -0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 37.61 3fga h ASN 172 CO 0.04 1.08 0.14 -0.07 -1.06 0.00 0.00 177.43 177.56 3fga h LEU 173 N 0.52 0.55 -2.63 1.61 3.38 -1.18 -2.30 115.31 115.27 3fga h LEU 173 Ca 0.03 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3fga h LEU 173 Cb 1.03 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 3fga h LEU 173 CO 0.10 0.59 0.12 0.00 0.09 0.00 0.00 178.44 179.34 3fga n SER 175 N -3.01 3.83 -4.73 0.00 3.41 -0.89 -4.86 113.62 107.37 3fga n SER 175 Ca -0.03 -3.79 -0.33 0.00 -0.26 0.00 0.00 58.87 54.46 3fga n SER 175 Cb 0.19 -0.40 0.09 0.00 -0.26 0.00 0.00 64.21 63.82 3fga n SER 175 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3fga s ASP 176 N -3.48 4.34 0.34 4.04 2.15 -0.72 -4.94 116.67 118.40 3fga s ASP 176 Ca 0.46 2.21 0.14 0.00 0.43 0.00 0.00 52.55 55.79 3fga s ASP 176 Cb 0.40 -2.57 0.61 0.00 -0.30 0.00 0.00 42.92 41.05 3fga s ASP 176 CO 0.00 -2.16 1.74 0.44 -0.17 0.00 0.00 175.17 175.02 3fga h ASP 177 N -0.42 0.00 -3.06 -0.34 3.45 -1.91 -3.44 116.42 110.70 3fga h ASP 177 Ca -0.47 0.00 -0.61 0.00 0.43 0.00 0.00 57.03 56.38 3fga h ASP 177 Cb 1.27 0.00 -0.08 0.00 -0.56 0.00 0.00 39.33 39.97 3fga h ASP 177 CO 0.50 0.45 -0.30 0.42 -1.57 0.00 0.00 179.24 178.74 3fga s THR 178 N -3.83 5.24 0.34 0.35 -4.23 -1.26 -4.98 115.64 107.27 3fga s THR 178 Ca -0.02 0.61 0.38 0.00 -1.18 0.00 0.00 61.69 61.48 3fga s THR 178 Cb 0.13 -3.62 0.40 0.00 1.34 0.00 0.00 72.50 70.74 3fga s THR 178 CO 0.72 0.50 2.15 1.55 -0.54 0.00 0.00 174.62 179.00 3fga h PRO 179 N 5.61 0.00 -0.43 3.99 0.13 -1.99 -2.86 132.00 136.45 3fga h PRO 179 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 3fga h PRO 179 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 3fga h PRO 179 CO 0.67 0.00 0.24 0.52 -0.23 0.00 0.00 178.00 179.20 3fga h MET 180 N 0.00 0.59 -0.00 0.86 2.86 -1.97 0.10 114.93 117.37 3fga h MET 180 Ca 0.00 -0.06 -0.21 0.00 -2.06 0.00 0.00 59.70 57.37 3fga h MET 180 Cb 0.17 -0.12 0.02 0.00 0.06 0.00 0.00 31.60 31.73 3fga h MET 180 CO 0.00 0.46 -0.80 0.28 1.06 0.00 0.00 176.91 177.91 3fga h VAL 181 N 0.56 1.36 -0.58 -2.22 2.07 -1.84 -2.83 116.25 112.77 3fga h VAL 181 Ca 0.15 -2.15 0.06 0.00 0.82 0.00 0.00 66.70 65.58 3fga h VAL 181 Cb 0.03 2.49 -0.05 0.00 -1.52 0.00 0.00 31.29 32.25 3fga h VAL 181 CO -0.03 0.65 0.30 0.03 0.02 0.00 0.00 177.57 178.54 3fga h ARG 182 N 0.13 0.54 -0.49 1.57 3.08 -1.41 0.19 114.38 117.99 3fga h ARG 182 Ca -0.10 -0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.01 3fga h ARG 182 Cb 1.49 -0.12 -0.08 0.00 0.08 0.00 0.00 29.97 31.34 3fga h ARG 182 CO 0.16 0.36 -0.01 0.00 -1.07 0.00 0.00 179.97 179.41 3fga h ARG 183 N 0.56 0.10 -0.00 0.04 3.08 -0.79 -0.82 114.38 116.55 3fga h ARG 183 Ca 0.26 -0.01 -0.14 0.00 0.07 0.00 0.00 59.98 60.17 3fga h ARG 183 Cb 0.18 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 3fga h ARG 183 CO -0.19 0.07 -0.64 0.00 -1.07 0.00 0.00 179.97 178.14 3fga h ALA 184 N 1.44 0.93 0.63 0.04 0.00 -1.00 -2.24 119.26 119.07 3fga h ALA 184 Ca 0.24 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 3fga h ALA 184 Cb 0.37 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.06 3fga h ALA 184 CO -0.41 0.80 -0.30 0.00 0.00 0.00 0.00 179.25 179.33 3fga h ALA 185 N 1.35 -0.98 -0.73 0.00 0.00 -0.33 -3.08 119.26 115.50 3fga h ALA 185 Ca -0.01 -0.19 0.21 0.00 0.00 0.00 0.00 54.91 54.93 3fga h ALA 185 Cb 1.14 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 19.23 3fga h ALA 185 CO 0.08 -0.91 0.69 0.00 0.00 0.00 0.00 179.25 179.11 3fga h ALA 186 N -1.39 2.54 -0.30 0.00 0.00 -1.01 0.58 119.26 119.68 3fga h ALA 186 Ca -0.09 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 3fga h ALA 186 Cb 0.65 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3fga h ALA 186 CO 0.14 -1.07 -0.09 0.77 0.00 0.00 0.00 179.25 179.01 3fga h SER 187 N 0.00 0.47 -0.37 0.00 0.02 -1.32 -3.11 113.55 109.23 3fga h SER 187 Ca 0.35 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 3fga h SER 187 Cb 1.73 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 64.14 3fga h SER 187 CO -0.00 0.60 0.00 0.29 -1.14 0.00 0.00 176.83 176.58 3fga n LYS 188 N -4.23 3.03 -0.04 3.45 4.76 0.20 -4.62 118.16 120.70 3fga n LYS 188 Ca 0.01 -2.46 -0.14 0.00 -2.87 0.00 0.00 58.31 52.85 3fga n LYS 188 Cb 0.30 -1.56 -0.08 0.00 -1.84 0.00 0.00 35.03 31.84 3fga n LYS 188 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3fga h LEU 189 N 2.32 0.32 0.15 -0.35 5.85 -1.40 -2.05 115.31 120.16 3fga h LEU 189 Ca 0.00 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.17 3fga h LEU 189 Cb 1.08 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.02 3fga h LEU 189 CO 0.11 0.80 -0.07 1.23 -0.34 0.00 0.00 178.44 180.17 3fga h GLY 190 N -0.15 -0.21 -0.62 3.75 0.00 -1.82 0.18 103.07 104.21 3fga h GLY 190 Ca 0.01 0.08 0.18 0.00 0.00 0.00 0.00 47.33 47.59 3fga h GLY 190 CO 0.04 -0.08 -0.14 -2.09 0.00 0.00 0.00 176.54 174.27 3fga h GLU 191 N -0.32 0.02 0.13 4.80 4.81 -1.85 -0.82 114.58 121.35 3fga h GLU 191 Ca -0.02 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 3fga h GLU 191 Cb 0.25 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.63 3fga h GLU 191 CO 0.03 0.01 -0.06 0.35 -0.73 0.00 0.00 179.01 178.62 3fga h PHE 192 N 0.02 -0.16 -0.69 0.92 3.57 -1.00 -3.15 116.94 116.45 3fga h PHE 192 Ca 0.42 -0.00 0.14 0.00 3.53 0.00 0.00 57.97 62.05 3fga h PHE 192 Cb 0.68 0.05 -0.13 0.00 2.79 0.00 0.00 35.95 39.35 3fga h PHE 192 CO -0.59 0.20 -0.20 0.00 -2.23 0.00 0.00 178.31 175.50 3fga h ALA 193 N 0.24 0.39 0.00 2.41 0.00 0.18 0.16 119.26 122.64 3fga h ALA 193 Ca -0.02 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3fga h ALA 193 Cb 0.44 0.57 0.00 0.00 0.00 0.00 0.00 17.79 18.80 3fga h ALA 193 CO 0.03 -0.45 0.05 1.63 0.00 0.00 0.00 179.25 180.51 3fga n LYS 194 N -5.46 0.00 0.00 0.00 5.02 -0.39 -0.82 118.16 116.51 3fga n LYS 194 Ca 0.08 0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 3fga n LYS 194 Cb 0.36 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 3fga n LYS 194 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3fga n VAL 195 N -1.06 0.00 -2.53 -0.18 0.31 0.53 -5.05 118.33 110.36 3fga n VAL 195 Ca 0.00 -0.48 -0.29 0.00 -0.01 0.00 0.00 64.34 63.55 3fga n VAL 195 Cb 0.05 1.01 -0.01 0.00 -0.91 0.00 0.00 33.84 33.98 3fga n VAL 195 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3fga s LEU 196 N -1.59 3.61 0.41 7.52 1.02 0.00 -4.65 118.68 125.01 3fga s LEU 196 Ca 0.00 1.14 -0.24 0.00 0.02 0.00 0.00 54.13 55.05 3fga s LEU 196 Cb 0.00 -4.09 -0.08 0.00 0.02 0.00 0.00 46.19 42.03 3fga s LEU 196 CO 0.00 -0.58 1.11 -1.83 0.02 0.00 0.00 176.35 175.07 3fga s GLU 197 N -4.49 4.04 0.28 1.70 1.03 -1.26 -4.87 118.70 115.13 3fga s GLU 197 Ca 0.51 1.66 -0.02 0.00 0.03 0.00 0.00 54.97 57.15 3fga s GLU 197 Cb -0.10 -2.55 0.42 0.00 -0.80 0.00 0.00 34.13 31.09 3fga s GLU 197 CO 0.41 -0.28 1.93 1.25 -1.33 0.00 0.00 175.26 177.25 3fga h LEU 198 N 2.45 1.00 0.00 1.83 5.85 -1.96 -1.28 115.31 123.19 3fga h LEU 198 Ca -0.49 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.22 3fga h LEU 198 Cb 1.23 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.02 3fga h LEU 198 CO 0.62 0.69 0.00 -0.90 -0.34 0.00 0.00 178.44 178.51 3fga n ASP 199 N -4.43 0.00 0.08 1.25 5.68 -1.26 -1.57 116.55 116.30 3fga n ASP 199 Ca 0.12 0.34 -0.10 0.00 -0.50 0.00 0.00 54.79 54.65 3fga n ASP 199 Cb 0.08 -0.44 -0.04 0.00 -1.14 0.00 0.00 41.12 39.58 3fga n ASP 199 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 3fga h ASN 200 N 0.00 0.26 -0.22 -1.12 -0.26 -1.63 -2.30 115.58 110.32 3fga h ASN 200 Ca 0.00 -0.23 0.04 0.00 -0.56 0.00 0.00 56.30 55.55 3fga h ASN 200 Cb 0.43 -0.08 -0.04 0.00 -1.06 0.00 0.00 38.32 37.57 3fga h ASN 200 CO 0.00 1.06 -0.03 0.58 -1.06 0.00 0.00 177.43 177.98 3fga h VAL 201 N 0.10 0.81 -0.20 2.81 2.07 -0.81 -0.15 116.25 120.87 3fga h VAL 201 Ca -0.05 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 3fga h VAL 201 Cb 1.60 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 3fga h VAL 201 CO 0.14 0.01 0.11 0.11 0.02 0.00 0.00 177.57 177.95 3fga h LYS 202 N 0.03 0.28 0.00 1.57 1.57 -1.49 -2.53 116.57 116.00 3fga h LYS 202 Ca 0.10 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.77 3fga h LYS 202 Cb 0.15 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 3fga h LYS 202 CO -0.20 0.28 -1.04 0.66 -0.57 0.00 0.00 179.45 178.57 3fga h SER 203 N 0.21 0.00 0.00 0.86 4.64 -1.30 -3.37 113.55 114.59 3fga h SER 203 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3fga h SER 203 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3fga h SER 203 CO -0.01 0.30 -0.78 -0.62 -0.87 0.00 0.00 176.83 174.85 3fga n GLU 204 N -2.86 2.10 -0.01 4.77 1.02 -0.09 -4.68 120.64 120.90 3fga n GLU 204 Ca -0.04 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.94 3fga n GLU 204 Cb 0.69 -0.89 -0.10 0.00 -0.02 0.00 0.00 31.44 31.12 3fga n GLU 204 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3fga h ILE 205 N 0.00 1.44 -0.19 -3.67 2.04 -1.26 -3.05 117.51 112.82 3fga h ILE 205 Ca 0.00 -1.96 0.05 0.00 1.00 0.00 0.00 64.86 63.96 3fga h ILE 205 Cb 0.78 2.53 -0.07 0.00 -0.74 0.00 0.00 36.82 39.31 3fga h ILE 205 CO 0.00 0.56 -0.33 0.40 0.00 0.00 0.00 178.15 178.79 3fga h ILE 206 N -0.16 0.26 -0.44 -0.67 1.08 -1.63 0.26 117.51 116.22 3fga h ILE 206 Ca -0.05 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.51 3fga h ILE 206 Cb 1.17 0.26 -0.08 0.00 -3.07 0.00 0.00 36.82 35.11 3fga h ILE 206 CO 0.09 0.00 -0.09 1.55 -0.69 0.00 0.00 178.15 179.01 3fga h PRO 207 N -0.37 0.02 -0.64 2.37 0.13 -1.83 0.41 132.00 132.08 3fga h PRO 207 Ca 0.11 -0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.34 3fga h PRO 207 Cb 0.55 -0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.60 3fga h PRO 207 CO -0.40 0.01 0.26 0.52 -0.23 0.00 0.00 178.00 178.16 3fga h MET 208 N 0.02 0.43 -0.47 0.86 2.86 -1.24 -1.75 114.93 115.64 3fga h MET 208 Ca 0.21 -0.03 -0.11 0.00 -2.06 0.00 0.00 59.70 57.71 3fga h MET 208 Cb 0.32 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 3fga h MET 208 CO -0.44 0.29 -0.15 0.35 1.06 0.00 0.00 176.91 178.02 3fga h PHE 209 N 0.44 1.05 -0.62 -0.22 3.57 0.38 -2.19 116.94 119.36 3fga h PHE 209 Ca 0.33 -0.24 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 3fga h PHE 209 Cb 0.40 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 3fga h PHE 209 CO -0.16 1.03 0.27 1.03 -2.23 0.00 0.00 178.31 178.25 3fga h SER 210 N 0.77 0.83 -0.45 0.41 0.87 0.16 -1.00 113.55 115.14 3fga h SER 210 Ca 0.11 -0.15 -0.03 0.00 -1.23 0.00 0.00 61.79 60.50 3fga h SER 210 Cb 0.71 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.43 3fga h SER 210 CO 0.05 0.76 0.18 0.78 -0.53 0.00 0.00 176.83 178.07 3fga h ASN 211 N 0.86 0.62 0.18 6.23 -0.26 -1.23 -2.75 115.58 119.22 3fga h ASN 211 Ca 0.21 -0.17 -0.08 0.00 -0.56 0.00 0.00 56.30 55.70 3fga h ASN 211 Cb 0.17 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.25 3fga h ASN 211 CO -0.02 0.61 -0.30 -0.07 -1.06 0.00 0.00 177.43 176.59 3fga h LEU 212 N 0.58 0.20 -0.55 1.61 3.38 -1.19 -2.72 115.31 116.62 3fga h LEU 212 Ca 0.15 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3fga h LEU 212 Cb 0.19 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3fga h LEU 212 CO -0.01 0.50 0.00 0.00 0.09 0.00 0.00 178.44 179.02 3fga h ALA 213 N 1.51 1.00 -0.16 1.53 0.00 -0.94 -2.32 119.26 119.88 3fga h ALA 213 Ca 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3fga h ALA 213 Cb 0.63 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 3fga h ALA 213 CO 0.05 0.00 -0.21 -1.13 0.00 0.00 0.00 179.25 177.96 3fga n SER 214 N -2.50 2.33 -4.74 0.00 3.41 -1.06 -4.84 113.62 106.23 3fga n SER 214 Ca 0.03 -3.64 -0.34 0.00 -0.26 0.00 0.00 58.87 54.66 3fga n SER 214 Cb 0.34 -0.56 0.07 0.00 -0.26 0.00 0.00 64.21 63.80 3fga n SER 214 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3fga s ASP 215 N -2.78 4.56 0.18 4.04 -1.08 -0.87 -4.95 116.67 115.76 3fga s ASP 215 Ca 0.40 2.26 -0.11 0.00 -0.52 0.00 0.00 52.55 54.58 3fga s ASP 215 Cb 0.37 -2.58 0.08 0.00 -1.46 0.00 0.00 42.92 39.33 3fga s ASP 215 CO -0.01 -2.01 1.72 1.05 0.52 0.00 0.00 175.17 176.44 3fga h GLU 216 N -0.07 0.93 -6.43 4.34 4.11 -1.91 -3.42 114.58 112.13 3fga h GLU 216 Ca -0.48 -0.18 -0.54 0.00 0.07 0.00 0.00 59.36 58.24 3fga h GLU 216 Cb 1.28 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 3fga h GLU 216 CO 0.51 0.80 0.53 -0.65 0.07 0.00 0.00 179.01 180.27 3fga s GLN 217 N -5.50 4.45 0.19 1.06 -1.52 -1.26 -4.92 119.66 112.16 3fga s GLN 217 Ca -0.13 1.64 0.25 0.00 -1.95 0.00 0.00 55.36 55.17 3fga s GLN 217 Cb 0.13 -3.42 0.90 0.00 -0.22 0.00 0.00 33.01 30.41 3fga s GLN 217 CO 0.80 -0.23 1.75 -0.40 -0.25 0.00 0.00 175.29 176.96 3fga n ASP 218 N 4.16 0.61 0.12 5.90 3.85 -1.26 -2.48 116.55 127.44 3fga n ASP 218 Ca 0.08 0.59 -0.02 0.00 -0.71 0.00 0.00 54.79 54.73 3fga n ASP 218 Cb 0.48 -0.74 0.11 0.00 -1.35 0.00 0.00 41.12 39.61 3fga n ASP 218 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 3fga h SER 219 N 0.00 0.00 -0.00 -1.12 4.64 -1.95 -2.12 113.55 112.99 3fga h SER 219 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3fga h SER 219 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 3fga h SER 219 CO 0.00 0.70 -0.03 0.58 -0.87 0.00 0.00 176.83 177.21 3fga h VAL 220 N 0.00 1.59 -0.82 0.95 2.07 -1.87 -3.35 116.25 114.82 3fga h VAL 220 Ca -0.01 -1.77 0.13 0.00 0.82 0.00 0.00 66.70 65.88 3fga h VAL 220 Cb 1.25 2.78 -0.09 0.00 -1.52 0.00 0.00 31.29 33.71 3fga h VAL 220 CO 0.09 0.46 0.42 0.03 0.02 0.00 0.00 177.57 178.59 3fga h ARG 221 N -0.71 0.61 0.00 1.57 3.08 -1.37 -1.40 114.38 116.15 3fga h ARG 221 Ca -0.00 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 59.96 3fga h ARG 221 Cb 0.77 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 3fga h ARG 221 CO 0.01 0.40 -0.25 1.37 -1.07 0.00 0.00 179.97 180.43 3fga h LEU 222 N 0.63 0.00 -1.02 3.04 -0.00 -1.54 -1.82 115.31 114.59 3fga h LEU 222 Ca 0.44 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 58.25 3fga h LEU 222 Cb 0.58 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.23 3fga h LEU 222 CO -0.34 0.25 -0.31 -0.07 -0.00 0.00 0.00 178.44 177.96 3fga h LEU 223 N 0.00 0.00 -0.88 0.17 3.38 -1.38 -3.07 115.31 113.53 3fga h LEU 223 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 3fga h LEU 223 Cb 0.68 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 3fga h LEU 223 CO 0.03 0.31 -0.55 0.00 0.09 0.00 0.00 178.44 178.32 3fga h ALA 224 N 1.69 1.07 -0.00 1.53 0.00 -1.14 -2.93 119.26 119.48 3fga h ALA 224 Ca -0.00 -0.50 0.01 0.00 0.00 0.00 0.00 54.91 54.42 3fga h ALA 224 Cb 0.83 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3fga h ALA 224 CO 0.04 0.69 -0.06 0.28 0.00 0.00 0.00 179.25 180.20 3fga h VAL 225 N 0.03 0.84 -0.68 0.00 2.07 -1.51 -0.40 116.25 116.59 3fga h VAL 225 Ca -0.00 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.66 3fga h VAL 225 Cb 0.98 0.84 -0.10 0.00 -1.52 0.00 0.00 31.29 31.49 3fga h VAL 225 CO 0.07 0.00 0.14 -0.33 0.02 0.00 0.00 177.57 177.47 3fga h GLU 226 N -0.11 0.24 -0.81 1.57 5.08 -1.60 -1.72 114.58 117.23 3fga h GLU 226 Ca 0.03 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 3fga h GLU 226 Cb 0.14 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 3fga h GLU 226 CO -0.07 0.16 0.38 0.00 -1.00 0.00 0.00 179.01 178.49 3fga h ALA 227 N 1.57 1.05 -0.93 3.43 0.00 -1.25 -2.37 119.26 120.75 3fga h ALA 227 Ca 0.37 -0.16 0.25 0.00 0.00 0.00 0.00 54.91 55.37 3fga h ALA 227 Cb 0.61 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 3fga h ALA 227 CO -0.48 0.62 0.64 0.00 0.00 0.00 0.00 179.25 180.02 3fga h VAL 229 N 0.18 1.04 -0.57 0.00 2.07 -1.34 0.54 116.25 118.16 3fga h VAL 229 Ca 0.47 -0.94 0.07 0.00 0.82 0.00 0.00 66.70 67.11 3fga h VAL 229 Cb 1.54 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.88 3fga h VAL 229 CO -0.10 0.22 0.38 0.78 0.02 0.00 0.00 177.57 178.87 3fga h ASN 230 N -0.65 0.44 -0.05 0.57 4.21 -1.39 -2.05 115.58 116.67 3fga h ASN 230 Ca -0.02 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.40 3fga h ASN 230 Cb 0.49 -0.09 0.01 0.00 -1.12 0.00 0.00 38.32 37.60 3fga h ASN 230 CO 0.03 0.29 -0.35 0.40 -1.29 0.00 0.00 177.43 176.50 3fga h ILE 231 N 0.50 1.44 0.00 2.81 2.04 -0.93 -3.15 117.51 120.23 3fga h ILE 231 Ca 0.25 -1.81 -0.04 0.00 1.00 0.00 0.00 64.86 64.26 3fga h ILE 231 Cb 0.35 2.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.85 3fga h ILE 231 CO -0.07 0.52 -0.19 0.00 0.00 0.00 0.00 178.15 178.40 3fga h ALA 232 N 0.39 1.51 0.00 1.87 0.00 -0.61 -2.61 119.26 119.81 3fga h ALA 232 Ca -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3fga h ALA 232 Cb 1.03 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3fga h ALA 232 CO 0.07 0.24 0.00 1.04 0.00 0.00 0.00 179.25 180.60 3fga n GLN 233 N -4.06 0.19 -0.21 0.00 6.02 -0.80 -2.92 117.38 115.60 3fga n GLN 233 Ca -0.02 0.25 0.11 0.00 -0.01 0.00 0.00 57.00 57.33 3fga n GLN 233 Cb 0.27 -1.76 0.26 0.00 1.02 0.00 0.00 30.24 30.03 3fga n GLN 233 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3fga n LEU 234 N -2.10 3.14 -3.82 1.08 4.77 -0.98 -4.98 117.00 114.11 3fga n LEU 234 Ca 0.05 -1.42 -0.12 0.00 -0.03 0.00 0.00 56.01 54.48 3fga n LEU 234 Cb 0.34 -0.28 -0.10 0.00 -2.33 0.00 0.00 43.42 41.06 3fga n LEU 234 CO 0.26 0.71 -0.09 -0.76 -1.33 0.00 0.00 177.39 176.18 3fga s LEU 235 N -1.34 1.23 0.43 2.23 1.43 -1.15 -5.05 118.68 116.46 3fga s LEU 235 Ca 0.39 -0.01 0.08 0.00 -1.03 0.00 0.00 54.13 53.56 3fga s LEU 235 Cb 0.22 0.92 0.01 0.00 0.03 0.00 0.00 46.19 47.37 3fga s LEU 235 CO 0.30 -0.36 0.56 -2.16 0.23 0.00 0.00 176.35 174.92 3fga s PRO 236 N -1.17 2.77 0.31 1.29 0.04 -1.26 -4.95 135.00 132.03 3fga s PRO 236 Ca -0.12 -1.29 0.06 0.00 0.04 0.00 0.00 61.00 59.68 3fga s PRO 236 Cb -0.06 -2.72 0.83 0.00 0.04 0.00 0.00 34.50 32.59 3fga s PRO 236 CO 0.02 -0.30 1.64 0.37 0.04 0.00 0.00 177.00 178.78 3fga h GLN 237 N 0.65 0.21 0.06 4.56 -0.00 -1.94 -2.67 115.11 115.97 3fga h GLN 237 Ca -0.40 -0.01 -0.24 0.00 -0.00 0.00 0.00 58.65 58.00 3fga h GLN 237 Cb 1.28 -0.05 -0.00 0.00 0.00 0.00 0.00 27.48 28.71 3fga h GLN 237 CO 0.46 0.14 -1.06 1.05 0.00 0.00 0.00 178.83 179.42 3fga h GLU 238 N 0.21 0.29 0.00 1.69 9.09 -1.96 -3.16 114.58 120.74 3fga h GLU 238 Ca 0.61 -0.39 -0.08 0.00 0.05 0.00 0.00 59.36 59.55 3fga h GLU 238 Cb 1.30 0.13 -0.01 0.00 -1.65 0.00 0.00 28.75 28.52 3fga h GLU 238 CO -0.67 1.12 -0.40 -0.44 0.05 0.00 0.00 179.01 178.67 3fga h ASP 239 N 0.13 0.00 -0.66 3.06 3.45 -1.87 -3.20 116.42 117.32 3fga h ASP 239 Ca -0.09 0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.38 3fga h ASP 239 Cb 1.74 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 40.48 3fga h ASP 239 CO 0.17 0.40 0.44 -0.07 -1.57 0.00 0.00 179.24 178.61 3fga h LEU 240 N 0.00 0.75 -0.85 1.55 3.38 -1.59 -2.78 115.31 115.76 3fga h LEU 240 Ca -0.00 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3fga h LEU 240 Cb 0.93 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 3fga h LEU 240 CO 0.05 0.54 0.42 -0.08 0.09 0.00 0.00 178.44 179.46 3fga h GLU 241 N 0.89 1.22 -0.11 1.13 4.57 -1.68 -1.51 114.58 119.09 3fga h GLU 241 Ca 0.25 -0.17 -0.18 0.00 -1.18 0.00 0.00 59.36 58.08 3fga h GLU 241 Cb -0.09 -0.22 0.01 0.00 -0.16 0.00 0.00 28.75 28.29 3fga h GLU 241 CO -0.06 0.93 -0.62 0.00 -1.18 0.00 0.00 179.01 178.07 3fga h ALA 242 N 1.22 0.22 -1.95 2.92 0.00 -1.69 -3.40 119.26 116.58 3fga h ALA 242 Ca 0.29 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3fga h ALA 242 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3fga h ALA 242 CO -0.04 0.49 0.00 1.28 0.00 0.00 0.00 179.25 180.98 3fga n LEU 243 N -4.12 0.00 0.18 0.00 4.77 -1.06 -4.65 117.00 112.12 3fga n LEU 243 Ca -0.08 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 55.96 3fga n LEU 243 Cb 0.67 -0.17 0.18 0.00 -2.33 0.00 0.00 43.42 41.77 3fga n LEU 243 CO 0.49 -0.17 0.62 -0.37 -1.33 0.00 0.00 177.39 176.62 3fga h VAL 244 N 0.00 0.66 -0.11 4.08 -1.51 -1.69 -3.36 116.25 114.32 3fga h VAL 244 Ca 0.00 -1.73 -0.08 0.00 -1.23 0.00 0.00 66.70 63.67 3fga h VAL 244 Cb 0.00 2.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.33 3fga h VAL 244 CO 0.00 0.35 -0.23 -0.03 -1.23 0.00 0.00 177.57 176.43 3fga h MET 245 N 0.00 0.35 0.00 5.19 4.05 -1.52 0.17 114.93 123.17 3fga h MET 245 Ca -0.00 -0.23 -0.02 0.00 -0.28 0.00 0.00 59.70 59.17 3fga h MET 245 Cb 1.14 0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.97 3fga h MET 245 CO 0.05 0.83 -0.08 -1.00 0.23 0.00 0.00 176.91 176.94 3fga h PRO 246 N -0.08 0.00 -0.10 0.39 0.13 -1.78 -0.70 132.00 129.86 3fga h PRO 246 Ca 0.00 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.94 3fga h PRO 246 Cb 0.83 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 3fga h PRO 246 CO 0.05 0.08 -0.74 1.15 -0.23 0.00 0.00 178.00 178.31 3fga h THR 247 N 0.00 1.35 -0.22 1.56 2.02 -1.67 -3.18 112.91 112.77 3fga h THR 247 Ca -0.00 -2.10 -0.10 0.00 0.77 0.00 0.00 66.41 64.99 3fga h THR 247 Cb 0.16 2.08 -0.00 0.00 -1.74 0.00 0.00 68.15 68.64 3fga h THR 247 CO 0.01 0.64 -0.24 0.25 0.37 0.00 0.00 175.52 176.55 3fga h LEU 248 N 0.34 0.59 -2.58 2.58 6.46 -0.19 -2.78 115.31 119.73 3fga h LEU 248 Ca -0.04 -0.48 -0.00 0.00 -0.12 0.00 0.00 57.88 57.24 3fga h LEU 248 Cb 1.33 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 41.09 3fga h LEU 248 CO 0.13 0.96 -0.01 -0.09 -0.62 0.00 0.00 178.44 178.81 3fga h ARG 249 N 0.24 0.00 0.01 1.25 2.43 -1.25 -2.56 114.38 114.50 3fga h ARG 249 Ca 0.03 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.11 3fga h ARG 249 Cb 0.79 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.35 3fga h ARG 249 CO 0.06 0.01 -0.36 1.96 -1.51 0.00 0.00 179.97 180.13 3fga h GLN 250 N 0.00 0.23 -0.78 0.20 1.08 -1.48 -3.31 115.11 111.05 3fga h GLN 250 Ca -0.00 -0.26 0.09 0.00 -1.45 0.00 0.00 58.65 57.04 3fga h GLN 250 Cb 0.04 0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 27.49 3fga h GLN 250 CO 0.00 0.99 0.51 0.00 -0.95 0.00 0.00 178.83 179.38 3fga h ALA 251 N 0.25 1.77 0.00 3.87 0.00 -1.23 0.19 119.26 124.11 3fga h ALA 251 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3fga h ALA 251 Cb 1.12 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3fga h ALA 251 CO 0.07 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.39 3fga h ALA 252 N 1.60 1.00 -0.06 0.00 0.00 -1.60 -2.25 119.26 117.94 3fga h ALA 252 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3fga h ALA 252 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3fga h ALA 252 CO -0.13 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.51 3fga n GLU 253 N -2.46 2.14 -1.69 0.00 1.02 0.54 -4.90 120.64 115.28 3fga n GLU 253 Ca 0.01 -2.26 -0.39 0.00 -0.02 0.00 0.00 57.16 54.50 3fga n GLU 253 Cb 0.19 -1.38 0.04 0.00 -0.02 0.00 0.00 31.44 30.27 3fga n GLU 253 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3fga n ASP 254 N -0.88 2.03 0.16 1.62 -0.08 -0.40 -4.86 116.55 114.13 3fga n ASP 254 Ca 0.12 0.95 0.12 0.00 -1.51 0.00 0.00 54.79 54.47 3fga n ASP 254 Cb 0.54 -1.50 0.56 0.00 2.34 0.00 0.00 41.12 43.07 3fga n ASP 254 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 3fga h LYS 255 N 1.24 0.00 -4.88 -0.67 2.10 -1.91 -3.41 116.57 109.04 3fga h LYS 255 Ca -0.49 0.00 -0.66 0.00 -2.00 0.00 0.00 60.65 57.50 3fga h LYS 255 Cb 1.32 0.00 -0.21 0.00 -0.90 0.00 0.00 32.23 32.44 3fga h LYS 255 CO 0.56 0.00 -0.58 0.45 -2.00 0.00 0.00 179.45 177.88 3fga s SER 256 N -4.24 5.49 0.60 7.07 0.15 -1.26 -4.95 113.70 116.56 3fga s SER 256 Ca 0.01 -0.28 0.30 0.00 0.70 0.00 0.00 55.95 56.69 3fga s SER 256 Cb 0.08 -2.00 1.73 0.00 -1.71 0.00 0.00 66.02 64.13 3fga s SER 256 CO 0.31 -0.10 2.12 4.11 1.20 0.00 0.00 173.24 180.88 3fga h TRP 257 N 8.31 0.00 -0.33 3.44 5.08 -1.99 0.35 115.95 130.81 3fga h TRP 257 Ca -0.35 0.00 -0.07 0.00 1.08 0.00 0.00 58.89 59.54 3fga h TRP 257 Cb 1.17 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.31 3fga h TRP 257 CO 0.68 0.00 -0.11 0.00 -1.28 0.00 0.00 178.44 177.73 3fga h ARG 258 N 0.00 0.56 0.03 0.12 3.08 -1.95 -0.38 114.38 115.84 3fga h ARG 258 Ca 0.07 -0.16 -0.11 0.00 0.07 0.00 0.00 59.98 59.85 3fga h ARG 258 Cb 0.44 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 30.44 3fga h ARG 258 CO -0.00 0.66 -0.43 0.28 -1.07 0.00 0.00 179.97 179.41 3fga h VAL 259 N 0.52 1.55 -0.02 2.04 2.07 -1.26 -3.15 116.25 118.00 3fga h VAL 259 Ca 0.10 -2.18 0.01 0.00 0.82 0.00 0.00 66.70 65.45 3fga h VAL 259 Cb 0.49 2.92 -0.00 0.00 -1.52 0.00 0.00 31.29 33.19 3fga h VAL 259 CO 0.03 0.60 0.02 0.03 0.02 0.00 0.00 177.57 178.27 3fga h ARG 260 N -0.45 0.00 -0.18 1.57 3.08 -1.30 -2.55 114.38 114.55 3fga h ARG 260 Ca -0.06 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 3fga h ARG 260 Cb 1.23 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.28 3fga h ARG 260 CO 0.08 0.00 -0.26 -0.92 -1.07 0.00 0.00 179.97 177.80 3fga h TYR 261 N 0.00 0.62 -0.09 3.04 3.20 -1.07 -2.18 116.97 120.49 3fga h TYR 261 Ca 0.01 -0.21 0.04 0.00 3.14 0.00 0.00 58.73 61.71 3fga h TYR 261 Cb 0.05 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 3fga h TYR 261 CO 0.00 0.90 -0.16 0.52 -1.64 0.00 0.00 178.16 177.78 3fga h MET 262 N 0.15 -0.21 -0.49 1.82 2.86 -1.42 0.39 114.93 118.04 3fga h MET 262 Ca 0.02 0.01 0.10 0.00 -2.06 0.00 0.00 59.70 57.77 3fga h MET 262 Cb 0.84 0.05 -0.10 0.00 0.06 0.00 0.00 31.60 32.45 3fga h MET 262 CO 0.06 -0.14 -0.17 0.28 1.06 0.00 0.00 176.91 178.01 3fga h VAL 263 N -0.22 0.43 -0.37 -2.22 2.07 -1.48 0.48 116.25 114.94 3fga h VAL 263 Ca 0.08 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.58 3fga h VAL 263 Cb 0.33 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3fga h VAL 263 CO -0.22 0.00 0.13 0.00 0.02 0.00 0.00 177.57 177.50 3fga h ALA 264 N 1.37 0.49 -0.18 1.67 0.00 -0.86 -2.30 119.26 119.44 3fga h ALA 264 Ca 0.23 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3fga h ALA 264 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3fga h ALA 264 CO -0.53 0.11 -0.10 0.22 0.00 0.00 0.00 179.25 178.95 3fga h ASP 265 N 0.46 0.27 -0.56 0.00 3.58 0.77 -2.66 116.42 118.27 3fga h ASP 265 Ca 0.12 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.52 3fga h ASP 265 Cb 0.23 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.21 3fga h ASP 265 CO -0.01 0.41 0.00 0.29 -2.88 0.00 0.00 179.24 177.05 3fga n LYS 266 N -4.28 4.55 -0.11 0.28 4.76 0.16 -4.77 118.16 118.76 3fga n LYS 266 Ca -0.00 -2.97 -0.12 0.00 -2.87 0.00 0.00 58.31 52.35 3fga n LYS 266 Cb 0.26 -2.18 -0.03 0.00 -1.84 0.00 0.00 35.03 31.24 3fga n LYS 266 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 3fga h PHE 267 N 3.85 0.72 -0.26 2.13 3.04 -1.05 -0.03 116.94 125.34 3fga h PHE 267 Ca 0.00 -0.17 -0.19 0.00 3.98 0.00 0.00 57.97 61.59 3fga h PHE 267 Cb 1.83 -0.17 0.00 0.00 2.56 0.00 0.00 35.95 40.17 3fga h PHE 267 CO 1.00 0.84 -0.58 1.79 -2.02 0.00 0.00 178.31 179.33 3fga h THR 268 N 0.39 1.28 -0.99 4.41 1.35 -1.86 -0.88 112.91 116.62 3fga h THR 268 Ca 0.07 -1.77 0.06 0.00 -0.55 0.00 0.00 66.41 64.22 3fga h THR 268 Cb 0.63 1.69 -0.07 0.00 -1.73 0.00 0.00 68.15 68.67 3fga h THR 268 CO 0.04 0.57 0.64 -0.33 -0.25 0.00 0.00 175.52 176.19 3fga h GLU 269 N 0.63 1.13 -0.66 4.72 5.08 -1.87 0.10 114.58 123.71 3fga h GLU 269 Ca 0.00 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 3fga h GLU 269 Cb 1.19 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 3fga h GLU 269 CO 0.13 0.75 0.26 -0.07 -1.00 0.00 0.00 179.01 179.07 3fga h LEU 270 N 1.16 0.89 -0.33 1.33 3.38 -0.79 -2.50 115.31 118.45 3fga h LEU 270 Ca 0.43 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.24 3fga h LEU 270 Cb 0.16 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3fga h LEU 270 CO -0.17 0.80 0.08 -0.61 0.09 0.00 0.00 178.44 178.63 3fga h GLN 271 N 0.95 0.53 0.00 1.13 4.15 0.59 -1.58 115.11 120.88 3fga h GLN 271 Ca 0.22 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.51 3fga h GLN 271 Cb 0.19 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.81 3fga h GLN 271 CO -0.02 0.59 0.00 1.63 -1.93 0.00 0.00 178.83 179.10 3fga n LYS 272 N -4.63 0.00 -0.29 1.69 5.02 -0.28 -1.51 118.16 118.15 3fga n LYS 272 Ca -0.02 0.56 0.10 0.00 -2.02 0.00 0.00 58.31 56.93 3fga n LYS 272 Cb 0.19 -1.48 0.21 0.00 -0.02 0.00 0.00 35.03 33.93 3fga n LYS 272 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fga n ALA 273 N -2.09 0.36 0.06 7.82 0.00 -0.94 -0.08 120.51 125.64 3fga n ALA 273 Ca 0.00 0.90 -0.15 0.00 0.00 0.00 0.00 53.44 54.19 3fga n ALA 273 Cb 0.00 -0.62 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 3fga n ALA 273 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3fga h VAL 274 N 0.00 1.36 0.00 0.00 2.07 -1.31 -3.41 116.25 114.96 3fga h VAL 274 Ca 0.47 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.64 3fga h VAL 274 Cb 0.91 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 3fga h VAL 274 CO -0.80 0.71 0.00 0.61 0.02 0.00 0.00 177.57 178.11 3fga n GLY 275 N 0.94 -0.94 0.41 2.17 0.00 0.89 -4.59 105.19 104.07 3fga n GLY 275 Ca -0.08 -1.56 0.23 0.00 0.00 0.00 0.00 46.02 44.61 3fga n GLY 275 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fga h PRO 276 N 0.00 0.00 0.33 1.61 0.13 -1.86 -2.54 132.00 129.68 3fga h PRO 276 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 3fga h PRO 276 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3fga h PRO 276 CO 0.00 0.00 -0.16 1.49 -0.23 0.00 0.00 178.00 179.10 3fga h GLU 277 N 0.00 -0.43 -0.09 0.86 4.22 -1.96 -2.54 114.58 114.64 3fga h GLU 277 Ca 0.29 0.03 -0.11 0.00 0.08 0.00 0.00 59.36 59.66 3fga h GLU 277 Cb 1.24 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 3fga h GLU 277 CO -0.00 -0.11 -0.42 0.82 -2.18 0.00 0.00 179.01 177.12 3fga h ILE 278 N -0.90 1.31 -0.27 2.32 2.04 -1.78 -2.79 117.51 117.44 3fga h ILE 278 Ca -0.05 -1.53 0.06 0.00 1.00 0.00 0.00 64.86 64.34 3fga h ILE 278 Cb 0.53 1.71 -0.06 0.00 -0.74 0.00 0.00 36.82 38.26 3fga h ILE 278 CO 0.08 0.45 -0.09 0.74 0.00 0.00 0.00 178.15 179.33 3fga h THR 279 N 0.17 0.68 0.13 -0.27 2.02 -1.48 0.67 112.91 114.82 3fga h THR 279 Ca 0.01 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.20 3fga h THR 279 Cb 0.82 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 3fga h THR 279 CO 0.06 0.00 -0.16 0.50 0.37 0.00 0.00 175.52 176.29 3fga h LYS 280 N -0.03 -0.32 -0.05 6.66 3.64 -1.27 0.36 116.57 125.56 3fga h LYS 280 Ca 0.14 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.48 3fga h LYS 280 Cb 0.24 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3fga h LYS 280 CO -0.30 -0.21 -0.19 0.00 -2.27 0.00 0.00 179.45 176.48 3fga h THR 281 N -0.33 1.45 0.02 1.00 1.03 -1.22 -3.37 112.91 111.48 3fga h THR 281 Ca 0.01 -1.61 -0.40 0.00 -0.01 0.00 0.00 66.41 64.40 3fga h THR 281 Cb 0.33 2.37 -0.06 0.00 -1.07 0.00 0.00 68.15 69.72 3fga h THR 281 CO -0.07 0.45 -2.34 0.47 -0.01 0.00 0.00 175.52 174.02 3fga n ASP 282 N -4.56 1.99 0.08 0.00 8.00 0.23 -4.62 116.55 117.66 3fga n ASP 282 Ca -0.08 0.08 0.13 0.00 0.71 0.00 0.00 54.79 55.63 3fga n ASP 282 Cb 0.42 -0.63 0.36 0.00 -0.02 0.00 0.00 41.12 41.25 3fga n ASP 282 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3fga n LEU 283 N -3.65 0.68 0.05 0.64 4.77 0.03 -3.51 117.00 116.01 3fga n LEU 283 Ca -0.45 0.45 -0.11 0.00 -0.03 0.00 0.00 56.01 55.86 3fga n LEU 283 Cb 0.95 -0.30 -0.08 0.00 -2.33 0.00 0.00 43.42 41.66 3fga n LEU 283 CO 0.22 -0.11 0.43 0.58 -1.33 0.00 0.00 177.39 177.18 3fga h VAL 284 N 0.00 0.94 -0.55 4.08 2.07 -1.48 -2.81 116.25 118.50 3fga h VAL 284 Ca 0.00 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.37 3fga h VAL 284 Cb 0.70 1.57 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 3fga h VAL 284 CO 0.00 0.24 0.36 -0.65 0.02 0.00 0.00 177.57 177.54 3fga h PRO 285 N -0.81 0.73 -0.57 1.57 0.11 -1.82 -2.84 132.00 128.37 3fga h PRO 285 Ca -0.02 -0.05 0.12 0.00 0.11 0.00 0.00 66.00 66.16 3fga h PRO 285 Cb 0.54 -0.16 -0.10 0.00 0.11 0.00 0.00 31.00 31.38 3fga h PRO 285 CO 0.03 0.49 -0.08 0.00 -0.21 0.00 0.00 178.00 178.24 3fga h ALA 286 N 1.20 0.46 -0.55 -0.75 0.00 -1.66 -2.04 119.26 115.91 3fga h ALA 286 Ca 0.20 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.30 3fga h ALA 286 Cb -0.08 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3fga h ALA 286 CO -0.04 -0.42 0.28 0.35 0.00 0.00 0.00 179.25 179.42 3fga h PHE 287 N 0.05 0.78 -0.28 0.00 3.57 -1.33 -0.55 116.94 119.18 3fga h PHE 287 Ca 0.28 -0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.80 3fga h PHE 287 Cb 0.45 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.90 3fga h PHE 287 CO -0.41 0.59 -0.01 1.96 -2.23 0.00 0.00 178.31 178.21 3fga h GLN 288 N 0.74 0.07 -0.00 1.11 4.20 -1.21 0.11 115.11 120.13 3fga h GLN 288 Ca 0.19 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.88 3fga h GLN 288 Cb 0.09 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.85 3fga h GLN 288 CO -0.03 0.05 -0.08 -0.91 -0.67 0.00 0.00 178.83 177.19 3fga h ASN 289 N 0.07 0.00 0.72 1.46 2.35 -0.95 -2.25 115.58 116.99 3fga h ASN 289 Ca 0.13 -0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.66 3fga h ASN 289 Cb 0.18 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 3fga h ASN 289 CO -0.23 0.08 -1.02 -0.07 -1.65 0.00 0.00 177.43 174.54 3fga h LEU 290 N 0.00 0.23 -0.33 1.61 3.38 -0.03 -2.33 115.31 117.84 3fga h LEU 290 Ca -0.00 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3fga h LEU 290 Cb 0.14 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3fga h LEU 290 CO 0.01 1.11 0.00 0.23 0.09 0.00 0.00 178.44 179.88 3fga n MET 291 N -3.53 0.14 -0.29 1.13 2.81 0.26 -2.75 117.12 114.88 3fga n MET 291 Ca -0.04 0.30 0.07 0.00 -1.81 0.00 0.00 57.70 56.22 3fga n MET 291 Cb 0.91 -1.73 0.20 0.00 -0.71 0.00 0.00 33.22 31.88 3fga n MET 291 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 3fga n LYS 292 N -1.99 2.90 -1.67 0.03 5.02 -0.89 -4.88 118.16 116.68 3fga n LYS 292 Ca 0.04 -2.39 -0.39 0.00 -2.02 0.00 0.00 58.31 53.55 3fga n LYS 292 Cb 0.26 -1.52 0.04 0.00 -0.02 0.00 0.00 35.03 33.80 3fga n LYS 292 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3fga n ASP 293 N 0.05 1.67 0.26 4.39 2.03 -0.90 -4.87 116.55 119.17 3fga n ASP 293 Ca 0.16 0.91 0.13 0.00 0.52 0.00 0.00 54.79 56.51 3fga n ASP 293 Cb 0.63 -1.46 0.70 0.00 -0.72 0.00 0.00 41.12 40.27 3fga n ASP 293 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3fga s GLU 295 N -4.13 4.02 0.22 0.00 2.56 -1.26 -5.00 118.70 115.11 3fga s GLU 295 Ca -0.02 -0.07 -0.08 0.00 0.00 0.00 0.00 54.97 54.79 3fga s GLU 295 Cb 0.13 -3.64 0.18 0.00 2.00 0.00 0.00 34.13 32.80 3fga s GLU 295 CO 0.59 -0.20 1.83 0.00 -0.56 0.00 0.00 175.26 176.92 3fga h ALA 296 N 8.10 1.08 -0.70 6.30 0.00 -1.99 -1.50 119.26 130.54 3fga h ALA 296 Ca -0.34 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 54.51 3fga h ALA 296 Cb 1.17 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 3fga h ALA 296 CO 0.62 0.61 0.46 0.93 0.00 0.00 0.00 179.25 181.88 3fga h GLU 297 N 1.18 0.67 0.13 0.00 5.08 -1.97 0.50 114.58 120.17 3fga h GLU 297 Ca 0.29 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.61 3fga h GLU 297 Cb 0.06 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.16 3fga h GLU 297 CO -0.04 0.44 -0.06 0.28 -1.00 0.00 0.00 179.01 178.63 3fga h VAL 298 N 0.69 1.01 -0.65 3.13 2.07 -1.65 -0.37 116.25 120.47 3fga h VAL 298 Ca 0.31 -0.57 0.06 0.00 0.82 0.00 0.00 66.70 67.32 3fga h VAL 298 Cb 0.32 1.36 -0.06 0.00 -1.52 0.00 0.00 31.29 31.39 3fga h VAL 298 CO -0.10 0.14 0.35 0.03 0.02 0.00 0.00 177.57 178.00 3fga h ARG 299 N -0.44 0.62 0.05 1.57 3.08 -0.60 -0.31 114.38 118.35 3fga h ARG 299 Ca -0.02 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.00 3fga h ARG 299 Cb 0.36 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3fga h ARG 299 CO 0.03 0.41 -0.09 0.00 -1.07 0.00 0.00 179.97 179.25 3fga h ALA 300 N 1.35 -0.13 -0.32 0.04 0.00 -0.01 -0.67 119.26 119.52 3fga h ALA 300 Ca 0.29 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.26 3fga h ALA 300 Cb 0.21 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 3fga h ALA 300 CO -0.19 -0.59 -0.11 0.00 0.00 0.00 0.00 179.25 178.35 3fga h ALA 301 N 0.77 0.16 -0.61 0.00 0.00 -0.52 -1.87 119.26 117.18 3fga h ALA 301 Ca 0.02 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 3fga h ALA 301 Cb 0.19 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3fga h ALA 301 CO -0.06 -0.50 0.15 0.00 0.00 0.00 0.00 179.25 178.85 3fga h ALA 302 N 1.23 1.12 -0.73 0.00 0.00 -0.93 -2.70 119.26 117.25 3fga h ALA 302 Ca 0.16 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.90 3fga h ALA 302 Cb 0.29 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3fga h ALA 302 CO -0.36 0.59 0.43 0.77 0.00 0.00 0.00 179.25 180.69 3fga h SER 303 N 0.91 0.67 -0.28 0.00 0.02 -0.34 -1.19 113.55 113.34 3fga h SER 303 Ca 0.20 0.02 0.08 0.00 -0.84 0.00 0.00 61.79 61.25 3fga h SER 303 Cb 0.32 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 3fga h SER 303 CO -0.00 0.44 0.42 0.45 -1.14 0.00 0.00 176.83 177.00 3fga h HIS 304 N 0.81 0.00 -0.05 3.45 3.86 -1.05 -1.69 115.15 120.47 3fga h HIS 304 Ca 0.32 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.53 3fga h HIS 304 Cb 0.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.61 3fga h HIS 304 CO -0.06 0.00 0.00 1.63 0.86 0.00 0.00 177.93 180.36 3fga n LYS 305 N -3.46 2.31 -0.25 2.45 4.76 -0.45 -4.62 118.16 118.91 3fga n LYS 305 Ca 0.04 -1.91 -0.02 0.00 -2.87 0.00 0.00 58.31 53.55 3fga n LYS 305 Cb 0.55 -1.46 0.10 0.00 -1.84 0.00 0.00 35.03 32.37 3fga n LYS 305 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3fga h VAL 306 N 4.59 1.02 0.14 -0.18 2.07 -1.30 -0.76 116.25 121.83 3fga h VAL 306 Ca 0.00 -0.27 -0.30 0.00 0.82 0.00 0.00 66.70 66.95 3fga h VAL 306 Cb 0.98 0.17 0.03 0.00 -1.52 0.00 0.00 31.29 30.94 3fga h VAL 306 CO 0.00 0.14 -1.27 0.07 0.02 0.00 0.00 177.57 176.53 3fga h LYS 307 N 0.78 0.56 0.10 1.57 5.09 -1.82 -2.99 116.57 119.86 3fga h LYS 307 Ca 0.30 -0.78 0.01 0.00 0.09 0.00 0.00 60.65 60.27 3fga h LYS 307 Cb 0.13 0.27 -0.02 0.00 0.10 0.00 0.00 32.23 32.70 3fga h LYS 307 CO -0.16 1.35 -0.18 0.93 -2.09 0.00 0.00 179.45 179.31 3fga h GLU 308 N 0.23 -0.33 0.20 0.07 4.39 -1.81 -0.25 114.58 117.07 3fga h GLU 308 Ca -0.19 0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.55 3fga h GLU 308 Cb 1.95 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 30.63 3fga h GLU 308 CO 0.24 -0.22 -0.41 0.35 -1.16 0.00 0.00 179.01 177.81 3fga h PHE 309 N -0.35 -1.14 -0.93 4.33 3.57 -1.22 -2.19 116.94 119.01 3fga h PHE 309 Ca 0.02 0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.68 3fga h PHE 309 Cb 0.36 0.47 -0.09 0.00 2.79 0.00 0.00 35.95 39.49 3fga h PHE 309 CO -0.18 -0.52 0.55 0.00 -2.23 0.00 0.00 178.31 175.93 3fga n GLU 311 N -4.72 0.14 -0.04 0.00 2.13 -0.11 -2.78 120.64 115.25 3fga n GLU 311 Ca 0.18 0.41 0.03 0.00 0.66 0.00 0.00 57.16 58.45 3fga n GLU 311 Cb 0.39 -1.78 0.05 0.00 0.27 0.00 0.00 31.44 30.37 3fga n GLU 311 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3fga n ASN 312 N -2.05 1.90 -4.76 4.31 4.13 -0.59 -5.00 115.26 113.19 3fga n ASN 312 Ca 0.02 -1.52 -0.39 0.00 1.68 0.00 0.00 54.58 54.37 3fga n ASN 312 Cb 0.19 -0.05 0.00 0.00 -1.54 0.00 0.00 39.78 38.38 3fga n ASN 312 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3fga s LEU 313 N -0.71 4.11 0.53 3.41 1.43 -1.08 -4.90 118.68 121.47 3fga s LEU 313 Ca 0.10 2.62 -0.20 0.00 -1.03 0.00 0.00 54.13 55.62 3fga s LEU 313 Cb 0.06 -4.03 -0.09 0.00 0.03 0.00 0.00 46.19 42.16 3fga s LEU 313 CO 0.09 -1.00 0.65 -1.54 0.23 0.00 0.00 176.35 174.78 3fga n SER 314 N -0.21 -0.45 0.04 2.29 3.41 -1.26 -4.80 113.62 112.64 3fga n SER 314 Ca 0.06 0.82 0.16 0.00 -0.26 0.00 0.00 58.87 59.64 3fga n SER 314 Cb 0.45 -1.22 0.64 0.00 -0.26 0.00 0.00 64.21 63.82 3fga n SER 314 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fga h ALA 315 N 0.54 2.30 0.01 7.33 0.00 -2.00 -2.89 119.26 124.56 3fga h ALA 315 Ca -0.45 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 3fga h ALA 315 Cb 1.39 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.18 3fga h ALA 315 CO 0.50 -0.42 -0.01 0.38 0.00 0.00 0.00 179.25 179.70 3fga h ASP 316 N 0.08 -0.01 0.96 0.00 3.04 -2.04 -3.39 116.42 115.06 3fga h ASP 316 Ca 0.20 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.99 3fga h ASP 316 Cb 0.71 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.00 3fga h ASP 316 CO -0.02 0.24 0.00 0.00 -2.04 0.00 0.00 179.24 177.43 3fga n ARG 318 N -1.76 -0.06 0.15 0.00 3.00 -1.09 -1.15 116.66 115.75 3fga n ARG 318 Ca 0.05 0.64 -0.14 0.00 -0.00 0.00 0.00 57.85 58.41 3fga n ARG 318 Cb 0.31 -0.96 -0.08 0.00 0.00 0.00 0.00 32.46 31.73 3fga n ARG 318 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 3fga h GLU 319 N 0.00 -0.36 -0.20 -0.14 4.39 -1.88 -2.89 114.58 113.50 3fga h GLU 319 Ca 0.18 0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.96 3fga h GLU 319 Cb 0.28 0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 28.96 3fga h GLU 319 CO -0.42 -0.08 -0.18 -0.97 -1.16 0.00 0.00 179.01 176.20 3fga h ASN 320 N -0.62 -0.58 -0.20 1.42 -0.73 -1.44 -0.68 115.58 112.75 3fga h ASN 320 Ca -0.04 0.11 -0.03 0.00 1.87 0.00 0.00 56.30 58.21 3fga h ASN 320 Cb 0.44 0.28 -0.01 0.00 0.27 0.00 0.00 38.32 39.31 3fga h ASN 320 CO 0.06 -0.22 -0.01 1.62 -0.37 0.00 0.00 177.43 178.51 3fga h VAL 321 N -0.19 1.26 -0.22 2.57 3.04 -1.49 -0.44 116.25 120.78 3fga h VAL 321 Ca 0.12 -0.90 -0.01 0.00 -1.01 0.00 0.00 66.70 64.91 3fga h VAL 321 Cb 0.38 1.45 -0.01 0.00 -2.01 0.00 0.00 31.29 31.09 3fga h VAL 321 CO -0.32 0.27 0.11 0.40 -1.01 0.00 0.00 177.57 177.02 3fga h ILE 322 N 0.12 1.14 0.00 3.17 2.04 -1.43 0.44 117.51 122.99 3fga h ILE 322 Ca 0.06 -0.40 -0.07 0.00 1.00 0.00 0.00 64.86 65.45 3fga h ILE 322 Cb 0.41 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 3fga h ILE 322 CO 0.01 0.14 -0.34 0.24 0.00 0.00 0.00 178.15 178.20 3fga h MET 323 N 0.22 0.00 0.00 2.37 2.86 -1.05 0.75 114.93 120.07 3fga h MET 323 Ca 0.08 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.55 3fga h MET 323 Cb 0.12 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.75 3fga h MET 323 CO -0.01 0.34 -1.63 -2.37 1.06 0.00 0.00 176.91 174.30 3fga n THR 324 N -3.37 0.63 -0.13 2.22 5.66 -0.18 -4.62 114.28 114.48 3fga n THR 324 Ca 0.01 -0.38 -0.26 0.00 -3.05 0.00 0.00 64.05 60.37 3fga n THR 324 Cb 0.54 -0.76 -0.10 0.00 -1.55 0.00 0.00 70.33 68.46 3fga n THR 324 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3fga n GLN 325 N -2.36 0.58 -0.09 1.09 1.13 0.15 -4.77 117.38 113.12 3fga n GLN 325 Ca -0.15 0.22 -0.23 0.00 -1.94 0.00 0.00 57.00 54.90 3fga n GLN 325 Cb 0.79 -1.46 -0.12 0.00 0.11 0.00 0.00 30.24 29.56 3fga n GLN 325 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 3fga n ILE 326 N -3.94 1.59 -0.26 5.09 5.41 -0.92 -4.34 119.36 122.00 3fga n ILE 326 Ca -0.50 -0.29 0.06 0.00 1.00 0.00 0.00 62.75 63.01 3fga n ILE 326 Cb 0.90 -1.88 0.18 0.00 -0.71 0.00 0.00 39.64 38.12 3fga n ILE 326 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 3fga h LEU 327 N -0.65 -0.25 -1.59 1.39 7.12 -1.11 -0.14 115.31 120.08 3fga h LEU 327 Ca -0.45 0.19 -0.03 0.00 0.13 0.00 0.00 57.88 57.71 3fga h LEU 327 Cb 1.59 0.31 -0.00 0.00 -0.53 0.00 0.00 40.66 42.03 3fga h LEU 327 CO -0.17 -0.16 -0.16 -0.65 -0.13 0.00 0.00 178.44 177.18 3fga h PRO 328 N 0.14 0.00 -0.22 5.25 0.11 -1.84 -1.87 132.00 133.56 3fga h PRO 328 Ca 0.43 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.47 3fga h PRO 328 Cb 0.77 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.87 3fga h PRO 328 CO -0.64 0.16 -0.14 0.00 -0.21 0.00 0.00 178.00 177.17 3fga h ILE 330 N 0.20 0.83 -0.99 0.00 2.04 -0.95 0.52 117.51 119.16 3fga h ILE 330 Ca 0.05 -0.08 0.04 0.00 1.00 0.00 0.00 64.86 65.86 3fga h ILE 330 Cb 0.66 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 37.25 3fga h ILE 330 CO 0.04 0.04 0.64 0.11 0.00 0.00 0.00 178.15 178.99 3fga h LYS 331 N 0.24 1.20 -0.25 2.37 1.57 -1.36 -0.86 116.57 119.49 3fga h LYS 331 Ca 0.19 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 3fga h LYS 331 Cb 0.21 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 3fga h LYS 331 CO -0.23 0.80 0.05 1.49 -0.57 0.00 0.00 179.45 180.99 3fga h GLU 332 N 1.24 0.40 -0.04 3.15 4.57 -1.01 -3.11 114.58 119.78 3fga h GLU 332 Ca 0.40 -0.10 -0.02 0.00 -1.18 0.00 0.00 59.36 58.46 3fga h GLU 332 Cb 0.01 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 28.55 3fga h GLU 332 CO -0.13 0.51 -0.07 -0.07 -1.18 0.00 0.00 179.01 178.07 3fga h LEU 333 N 0.22 0.05 -1.83 1.64 3.38 -0.30 -2.52 115.31 115.95 3fga h LEU 333 Ca 0.08 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.08 3fga h LEU 333 Cb 0.29 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3fga h LEU 333 CO 0.00 0.12 0.20 0.58 0.09 0.00 0.00 178.44 179.44 3fga h VAL 334 N 0.05 0.97 -0.41 1.22 2.07 -1.10 -2.27 116.25 116.78 3fga h VAL 334 Ca 0.01 -0.08 -0.19 0.00 0.82 0.00 0.00 66.70 67.26 3fga h VAL 334 Cb 0.16 0.73 -0.11 0.00 -1.52 0.00 0.00 31.29 30.54 3fga h VAL 334 CO 0.01 0.04 0.00 -1.54 0.02 0.00 0.00 177.57 176.10 3fga n SER 335 N -4.49 2.78 -4.74 0.57 3.41 -0.95 -4.97 113.62 105.23 3fga n SER 335 Ca 0.03 -3.67 -0.37 0.00 -0.26 0.00 0.00 58.87 54.60 3fga n SER 335 Cb 0.21 -0.65 0.06 0.00 -0.26 0.00 0.00 64.21 63.57 3fga n SER 335 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3fga s ASP 336 N -2.34 4.71 0.30 4.04 2.15 -0.85 -4.92 116.67 119.76 3fga s ASP 336 Ca 0.46 2.59 0.05 0.00 0.43 0.00 0.00 52.55 56.08 3fga s ASP 336 Cb 0.41 -2.62 0.49 0.00 -0.30 0.00 0.00 42.92 40.90 3fga s ASP 336 CO 0.02 -1.94 1.75 0.00 -0.17 0.00 0.00 175.17 174.84 3fga h ALA 337 N 0.62 1.18 -2.40 3.66 0.00 -1.93 -3.44 119.26 116.94 3fga h ALA 337 Ca -0.51 -0.34 -0.58 0.00 0.00 0.00 0.00 54.91 53.48 3fga h ALA 337 Cb 1.33 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.94 3fga h ALA 337 CO 0.53 0.53 0.36 1.21 0.00 0.00 0.00 179.25 181.89 3fga s ASN 338 N -6.84 6.91 0.26 0.00 2.47 -1.26 -4.95 114.94 111.53 3fga s ASN 338 Ca -0.06 1.12 -0.02 0.00 0.42 0.00 0.00 52.86 54.32 3fga s ASN 338 Cb 0.14 -2.44 0.56 0.00 -1.45 0.00 0.00 41.25 38.06 3fga s ASN 338 CO 0.77 -0.39 1.69 1.56 -3.72 0.00 0.00 177.10 177.01 3fga h GLN 339 N 7.37 0.31 0.00 0.43 7.50 -1.99 -2.71 115.11 126.03 3fga h GLN 339 Ca -0.29 -0.02 -0.19 0.00 0.50 0.00 0.00 58.65 58.65 3fga h GLN 339 Cb 1.13 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 28.58 3fga h GLN 339 CO 0.83 0.21 -0.85 0.45 -1.50 0.00 0.00 178.83 177.96 3fga h HIS 340 N 0.32 0.23 -0.07 2.96 3.86 -1.98 -0.41 115.15 120.06 3fga h HIS 340 Ca 0.47 -0.12 -0.21 0.00 -1.16 0.00 0.00 60.37 59.34 3fga h HIS 340 Cb 0.83 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.28 3fga h HIS 340 CO -0.22 0.93 -0.83 -0.39 0.86 0.00 0.00 177.93 178.28 3fga h VAL 341 N 0.08 1.35 -0.10 2.45 -1.51 -1.82 -1.54 116.25 115.17 3fga h VAL 341 Ca -0.03 -2.20 -0.04 0.00 -1.23 0.00 0.00 66.70 63.20 3fga h VAL 341 Cb 1.48 2.20 -0.01 0.00 -2.13 0.00 0.00 31.29 32.83 3fga h VAL 341 CO 0.13 0.67 -0.11 0.11 -1.23 0.00 0.00 177.57 177.14 3fga h LYS 342 N 0.33 0.15 -0.19 5.19 1.57 -1.44 -2.60 116.57 119.59 3fga h LYS 342 Ca -0.06 -0.03 -0.15 0.00 -1.87 0.00 0.00 60.65 58.54 3fga h LYS 342 Cb 1.44 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.73 3fga h LYS 342 CO 0.15 0.27 -0.46 1.03 -0.57 0.00 0.00 179.45 179.87 3fga h SER 343 N 0.15 0.74 -0.03 0.86 0.87 -0.61 -2.48 113.55 113.03 3fga h SER 343 Ca 0.03 -0.57 -0.00 0.00 -1.23 0.00 0.00 61.79 60.02 3fga h SER 343 Cb 0.29 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 62.04 3fga h SER 343 CO 0.02 1.17 0.01 0.00 -0.53 0.00 0.00 176.83 177.50 3fga h ALA 344 N 0.59 0.04 -0.15 6.23 0.00 -1.16 -3.06 119.26 121.74 3fga h ALA 344 Ca -0.00 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.86 3fga h ALA 344 Cb 1.07 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3fga h ALA 344 CO 0.10 -0.39 -0.00 1.25 0.00 0.00 0.00 179.25 180.20 3fga h LEU 345 N -0.09 -0.07 -1.99 0.00 5.85 -1.48 -1.91 115.31 115.63 3fga h LEU 345 Ca 0.01 0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.86 3fga h LEU 345 Cb 0.14 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 3fga h LEU 345 CO -0.00 -0.01 0.41 0.00 -0.34 0.00 0.00 178.44 178.50 3fga h ALA 346 N 1.13 2.00 -0.17 1.25 0.00 -1.36 -0.75 119.26 121.36 3fga h ALA 346 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3fga h ALA 346 Cb 0.09 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3fga h ALA 346 CO -0.12 -0.59 0.00 -1.13 0.00 0.00 0.00 179.25 177.40 3fga n SER 347 N -3.62 1.84 0.00 0.00 3.41 -0.72 -3.78 113.62 110.76 3fga n SER 347 Ca 0.06 -1.72 0.00 0.00 -0.26 0.00 0.00 58.87 56.95 3fga n SER 347 Cb 0.57 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 3fga n SER 347 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3fga n VAL 348 N 0.44 0.00 -0.20 -3.33 0.24 -0.47 -4.92 118.33 110.09 3fga n VAL 348 Ca 0.17 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.46 3fga n VAL 348 Cb 0.36 0.29 0.22 0.00 -1.47 0.00 0.00 33.84 33.24 3fga n VAL 348 CO 0.00 0.00 0.00 -0.29 -2.14 0.00 0.00 176.83 174.40 3fga h ILE 349 N 0.00 1.21 0.00 1.34 2.10 -1.38 -2.57 117.51 118.22 3fga h ILE 349 Ca 0.00 -0.52 -0.04 0.00 1.08 0.00 0.00 64.86 65.37 3fga h ILE 349 Cb 0.00 0.28 -0.01 0.00 -1.09 0.00 0.00 36.82 36.00 3fga h ILE 349 CO 0.00 0.23 -0.20 0.24 -1.08 0.00 0.00 178.15 177.34 3fga h MET 350 N 0.96 0.00 0.00 2.19 2.86 -1.85 -1.06 114.93 118.03 3fga h MET 350 Ca 0.24 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 3fga h MET 350 Cb 0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.69 3fga h MET 350 CO -0.04 0.20 0.00 0.41 1.06 0.00 0.00 176.91 178.54 3fga n GLY 351 N -0.52 -0.63 0.20 8.32 0.00 -0.97 -1.80 105.19 109.79 3fga n GLY 351 Ca -0.02 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.05 3fga n GLY 351 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3fga h LEU 352 N 0.00 0.00 0.13 0.99 4.07 -1.31 -3.39 115.31 115.80 3fga h LEU 352 Ca 0.00 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.97 3fga h LEU 352 Cb 0.10 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.82 3fga h LEU 352 CO 0.00 0.28 -0.20 0.28 -1.08 0.00 0.00 178.44 177.72 3fga h SER 353 N 0.00 -0.54 0.02 -0.43 0.02 -1.54 -0.72 113.55 110.36 3fga h SER 353 Ca -0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3fga h SER 353 Cb 0.90 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.64 3fga h SER 353 CO 0.04 -0.28 0.00 -0.81 -1.14 0.00 0.00 176.83 174.64 3fga n PRO 354 N -5.32 0.06 -0.03 3.45 -0.04 -1.26 -0.92 135.00 130.94 3fga n PRO 354 Ca -0.07 0.55 -0.15 0.00 -0.04 0.00 0.00 63.50 63.79 3fga n PRO 354 Cb 0.24 -1.69 -0.14 0.00 -0.04 0.00 0.00 33.50 31.87 3fga n PRO 354 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 3fga n ILE 355 N -1.81 1.66 0.44 0.52 2.08 -0.34 -4.18 119.36 117.72 3fga n ILE 355 Ca -0.00 -0.72 0.12 0.00 0.56 0.00 0.00 62.75 62.70 3fga n ILE 355 Cb 0.02 -1.33 0.06 0.00 -0.75 0.00 0.00 39.64 37.63 3fga n ILE 355 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 3fga n LEU 356 N -3.23 0.66 -0.27 1.39 4.77 -0.80 -5.04 117.00 114.48 3fga n LEU 356 Ca -0.28 0.14 0.04 0.00 -0.03 0.00 0.00 56.01 55.88 3fga n LEU 356 Cb 1.05 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 42.02 3fga n LEU 356 CO 0.42 -0.04 -0.08 0.61 -1.33 0.00 0.00 177.39 176.97 3fga n GLY 357 N 1.31 -1.94 0.44 -0.72 0.00 -0.10 -4.22 105.19 99.97 3fga n GLY 357 Ca 0.02 -1.43 -0.13 0.00 0.00 0.00 0.00 46.02 44.47 3fga n GLY 357 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3fga h LYS 358 N -0.26 -0.46 -0.43 1.61 3.64 -1.83 -2.12 116.57 116.72 3fga h LYS 358 Ca -0.01 0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 3fga h LYS 358 Cb 0.25 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 3fga h LYS 358 CO 0.01 -0.31 -0.26 -0.44 -2.27 0.00 0.00 179.45 176.18 3fga h ASP 359 N -0.48 0.95 -0.41 4.20 3.32 -1.94 -2.38 116.42 119.68 3fga h ASP 359 Ca 0.07 -0.38 -0.05 0.00 0.02 0.00 0.00 57.03 56.70 3fga h ASP 359 Cb 0.64 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 3fga h ASP 359 CO -0.50 1.15 0.07 0.78 -1.72 0.00 0.00 179.24 179.03 3fga h ASN 360 N 0.78 0.65 -0.04 6.45 -0.26 -1.70 -1.92 115.58 119.54 3fga h ASN 360 Ca 0.09 -0.25 0.02 0.00 -0.56 0.00 0.00 56.30 55.60 3fga h ASN 360 Cb 0.83 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 37.89 3fga h ASN 360 CO 0.07 0.74 -0.07 0.74 -1.06 0.00 0.00 177.43 177.85 3fga h THR 361 N 0.54 0.80 -0.42 2.81 2.02 -1.31 0.11 112.91 117.45 3fga h THR 361 Ca 0.13 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 3fga h THR 361 Cb 0.36 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 3fga h THR 361 CO 0.01 0.00 0.23 0.40 0.37 0.00 0.00 175.52 176.53 3fga h ILE 362 N -0.11 1.13 0.04 3.11 2.04 -1.33 0.19 117.51 122.58 3fga h ILE 362 Ca 0.04 -0.34 -0.07 0.00 1.00 0.00 0.00 64.86 65.49 3fga h ILE 362 Cb 0.17 0.56 0.01 0.00 -0.74 0.00 0.00 36.82 36.82 3fga h ILE 362 CO -0.11 0.15 -0.31 -0.08 0.00 0.00 0.00 178.15 177.80 3fga h GLU 363 N 0.59 0.14 0.00 2.37 4.81 -1.04 -3.39 114.58 118.05 3fga h GLU 363 Ca 0.15 -0.20 -0.13 0.00 -0.13 0.00 0.00 59.36 59.05 3fga h GLU 363 Cb 0.02 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 3fga h GLU 363 CO -0.03 1.05 -1.49 0.72 -0.73 0.00 0.00 179.01 178.53 3fga n HIS 364 N -4.44 0.00 0.09 0.92 8.25 0.35 -4.70 115.22 115.68 3fga n HIS 364 Ca -0.11 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.23 3fga n HIS 364 Cb 0.59 -0.33 -0.07 0.00 1.12 0.00 0.00 29.99 31.30 3fga n HIS 364 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3fga h LEU 365 N -0.03 0.32 0.16 2.41 3.38 -1.17 -3.37 115.31 117.01 3fga h LEU 365 Ca -0.20 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 3fga h LEU 365 Cb 1.29 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.94 3fga h LEU 365 CO -0.04 1.15 -0.08 0.25 0.09 0.00 0.00 178.44 179.81 3fga h LEU 366 N 0.10 -0.18 -1.38 1.67 5.85 -1.24 -1.80 115.31 118.33 3fga h LEU 366 Ca -0.07 -0.16 0.17 0.00 0.84 0.00 0.00 57.88 58.66 3fga h LEU 366 Cb 1.69 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 42.70 3fga h LEU 366 CO 0.16 0.05 0.58 -0.65 -0.34 0.00 0.00 178.44 178.24 3fga h PRO 367 N -0.42 0.54 0.91 5.25 0.11 -1.84 -1.53 132.00 135.02 3fga h PRO 367 Ca -0.02 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.01 3fga h PRO 367 Cb 0.33 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.33 3fga h PRO 367 CO 0.04 0.36 -0.44 -0.07 -0.21 0.00 0.00 178.00 177.68 3fga h LEU 368 N 0.56 -1.04 -0.87 2.35 3.38 -1.60 -1.01 115.31 117.08 3fga h LEU 368 Ca 0.46 0.03 0.18 0.00 0.09 0.00 0.00 57.88 58.63 3fga h LEU 368 Cb 0.91 0.27 -0.17 0.00 0.09 0.00 0.00 40.66 41.76 3fga h LEU 368 CO -0.20 -0.72 -0.21 -0.26 0.09 0.00 0.00 178.44 177.14 3fga h PHE 369 N -1.27 -0.46 -0.65 1.13 0.04 -0.72 0.29 116.94 115.30 3fga h PHE 369 Ca -0.12 0.08 0.04 0.00 2.80 0.00 0.00 57.97 60.76 3fga h PHE 369 Cb 0.94 0.34 -0.04 0.00 2.20 0.00 0.00 35.95 39.39 3fga h PHE 369 CO -0.00 -0.37 0.43 -0.07 -0.60 0.00 0.00 178.31 177.69 3fga h LEU 370 N 0.00 0.66 -0.60 1.54 3.38 -1.08 0.61 115.31 119.82 3fga h LEU 370 Ca 0.42 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.29 3fga h LEU 370 Cb 0.64 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3fga h LEU 370 CO -0.90 0.45 -0.46 0.00 0.09 0.00 0.00 178.44 177.62 3fga h ALA 371 N 1.62 0.85 0.09 1.53 0.00 0.90 -2.88 119.26 121.37 3fga h ALA 371 Ca 0.26 -0.42 -0.30 0.00 0.00 0.00 0.00 54.91 54.45 3fga h ALA 371 Cb 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3fga h ALA 371 CO -0.07 0.58 -1.54 1.96 0.00 0.00 0.00 179.25 180.17 3fga h GLN 372 N 0.00 0.19 -0.04 0.00 4.20 -0.40 -2.96 115.11 116.10 3fga h GLN 372 Ca -0.00 -0.33 0.01 0.00 0.06 0.00 0.00 58.65 58.39 3fga h GLN 372 Cb 1.11 0.12 -0.00 0.00 0.30 0.00 0.00 27.48 29.01 3fga h GLN 372 CO 0.06 1.02 0.07 -0.07 -0.67 0.00 0.00 178.83 179.24 3fga h LEU 373 N 0.05 0.00 -3.12 1.46 -0.00 0.23 -2.32 115.31 111.62 3fga h LEU 373 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.64 3fga h LEU 373 Cb 1.99 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.65 3fga h LEU 373 CO 0.14 0.00 0.00 2.29 -0.00 0.00 0.00 178.44 180.87 3fga n LYS 374 N -3.52 2.43 -1.76 1.13 2.85 -1.09 -4.93 118.16 113.27 3fga n LYS 374 Ca -0.02 -2.58 -0.36 0.00 -1.05 0.00 0.00 58.31 54.30 3fga n LYS 374 Cb 0.15 -1.62 0.06 0.00 -0.65 0.00 0.00 35.03 32.98 3fga n LYS 374 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 3fga s ASP 375 N -2.05 4.67 0.22 -5.58 2.15 -0.87 -4.93 116.67 110.28 3fga s ASP 375 Ca 0.34 2.53 0.07 0.00 0.43 0.00 0.00 52.55 55.92 3fga s ASP 375 Cb 0.27 -2.61 0.17 0.00 -0.30 0.00 0.00 42.92 40.45 3fga s ASP 375 CO 0.07 -1.96 1.50 -0.08 -0.17 0.00 0.00 175.17 174.53 3fga h GLU 376 N 0.49 0.10 -6.21 4.34 4.57 -1.91 -3.42 114.58 112.54 3fga h GLU 376 Ca -0.50 -0.09 -0.58 0.00 -1.18 0.00 0.00 59.36 57.01 3fga h GLU 376 Cb 1.32 0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 29.87 3fga h GLU 376 CO 0.53 0.79 0.84 0.00 -1.18 0.00 0.00 179.01 179.98 3fga h PRO 378 N 7.91 0.40 -0.34 0.00 0.13 -2.00 -2.13 132.00 135.96 3fga h PRO 378 Ca -0.21 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 64.82 3fga h PRO 378 Cb 1.06 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.09 3fga h PRO 378 CO 1.01 0.26 -0.11 0.93 -0.23 0.00 0.00 178.00 179.86 3fga h GLU 379 N 0.41 0.59 0.61 0.86 4.39 -1.96 0.42 114.58 119.89 3fga h GLU 379 Ca 0.21 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.71 3fga h GLU 379 Cb 0.32 -0.06 0.01 0.00 -0.10 0.00 0.00 28.75 28.91 3fga h GLU 379 CO -0.05 0.69 -0.29 0.28 -1.16 0.00 0.00 179.01 178.47 3fga h VAL 380 N 0.54 0.38 0.00 3.13 2.07 -1.72 -1.64 116.25 119.01 3fga h VAL 380 Ca 0.10 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.49 3fga h VAL 380 Cb 0.51 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 3fga h VAL 380 CO 0.03 0.01 -0.21 0.08 0.02 0.00 0.00 177.57 177.50 3fga h ARG 381 N -0.88 0.00 -0.18 1.57 0.11 -1.32 -1.96 114.38 111.73 3fga h ARG 381 Ca -0.08 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 59.95 3fga h ARG 381 Cb 0.65 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.72 3fga h ARG 381 CO 0.14 0.21 -0.06 1.25 0.10 0.00 0.00 179.97 181.61 3fga h LEU 382 N 0.00 0.36 -1.18 0.08 6.46 -0.85 -2.93 115.31 117.24 3fga h LEU 382 Ca -0.00 -0.38 0.00 0.00 -0.12 0.00 0.00 57.88 57.37 3fga h LEU 382 Cb 0.54 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 40.38 3fga h LEU 382 CO 0.03 0.66 0.00 0.78 -0.62 0.00 0.00 178.44 179.29 3fga h ASN 383 N 0.05 0.00 0.00 1.25 2.35 -0.56 -2.84 115.58 115.84 3fga h ASN 383 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3fga h ASN 383 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 3fga h ASN 383 CO 0.02 0.00 -1.51 0.00 -1.65 0.00 0.00 177.43 174.29 3fga n ILE 384 N -2.50 0.00 -0.03 2.81 0.00 -0.92 -3.93 119.36 114.80 3fga n ILE 384 Ca 0.01 -0.26 -0.16 0.00 0.00 0.00 0.00 62.75 62.34 3fga n ILE 384 Cb 0.20 0.48 -0.08 0.00 0.00 0.00 0.00 39.64 40.25 3fga n ILE 384 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3fga h ILE 385 N 0.00 1.33 -0.73 9.51 1.08 -1.32 -3.38 117.51 124.01 3fga h ILE 385 Ca 0.00 -1.83 0.20 0.00 -0.39 0.00 0.00 64.86 62.85 3fga h ILE 385 Cb 0.75 2.07 -0.14 0.00 -3.07 0.00 0.00 36.82 36.43 3fga h ILE 385 CO 0.00 0.56 0.02 -0.24 -0.69 0.00 0.00 178.15 177.80 3fga n SER 386 N -4.15 -0.09 -1.88 1.72 2.88 -1.20 -2.22 113.62 108.68 3fga n SER 386 Ca -0.07 1.24 -0.21 0.00 -1.33 0.00 0.00 58.87 58.50 3fga n SER 386 Cb 0.63 -0.45 0.04 0.00 -0.75 0.00 0.00 64.21 63.67 3fga n SER 386 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 3fga n ASN 387 N -5.01 4.64 0.05 -3.46 4.05 -1.26 -4.76 115.26 109.52 3fga n ASN 387 Ca 0.17 -3.77 -0.06 0.00 0.45 0.00 0.00 54.58 51.37 3fga n ASN 387 Cb 0.56 -0.37 0.11 0.00 1.23 0.00 0.00 39.78 41.32 3fga n ASN 387 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 3fga h LEU 388 N 2.06 0.40 -0.98 1.20 3.38 -1.68 -3.30 115.31 116.40 3fga h LEU 388 Ca 0.34 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3fga h LEU 388 Cb 1.48 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 42.07 3fga h LEU 388 CO 0.70 0.87 0.61 -0.78 0.09 0.00 0.00 178.44 179.92 3fga h ASP 389 N 0.28 1.15 -0.73 -0.43 3.58 -1.87 -0.35 116.42 118.05 3fga h ASP 389 Ca 0.00 -0.05 0.17 0.00 0.42 0.00 0.00 57.03 57.57 3fga h ASP 389 Cb 1.05 -0.29 -0.04 0.00 1.72 0.00 0.00 39.33 41.77 3fga h ASP 389 CO 0.09 0.86 0.50 0.00 -2.88 0.00 0.00 179.24 177.81 3fga h VAL 391 N 0.24 1.29 0.00 0.00 2.07 -1.23 -3.18 116.25 115.44 3fga h VAL 391 Ca 0.36 -2.37 -0.01 0.00 0.82 0.00 0.00 66.70 65.50 3fga h VAL 391 Cb 1.04 2.53 -0.00 0.00 -1.52 0.00 0.00 31.29 33.34 3fga h VAL 391 CO -0.08 0.73 -0.03 -1.13 0.02 0.00 0.00 177.57 177.08 3fga h ASN 392 N 0.33 0.00 0.60 0.57 -0.73 -0.22 -1.26 115.58 114.87 3fga h ASN 392 Ca -0.15 0.00 -0.21 0.00 1.87 0.00 0.00 56.30 57.81 3fga h ASN 392 Cb 1.79 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 40.37 3fga h ASN 392 CO 0.22 0.03 -0.95 -0.33 -0.37 0.00 0.00 177.43 176.02 3fga h GLU 393 N 0.00 0.21 0.00 6.67 5.08 -1.13 -3.37 114.58 122.04 3fga h GLU 393 Ca -0.00 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 3fga h GLU 393 Cb 0.08 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 3fga h GLU 393 CO 0.00 1.01 -0.17 -0.24 -1.00 0.00 0.00 179.01 178.62 3fga h VAL 394 N 0.10 0.37 -3.86 3.13 3.04 -1.41 -3.47 116.25 114.15 3fga h VAL 394 Ca -0.06 -1.30 -0.46 0.00 -1.01 0.00 0.00 66.70 63.87 3fga h VAL 394 Cb 1.61 0.72 0.10 0.00 -2.01 0.00 0.00 31.29 31.70 3fga h VAL 394 CO 0.15 0.12 0.29 0.27 -1.01 0.00 0.00 177.57 177.39 3fga s ILE 395 N -1.84 2.16 0.73 3.17 -4.36 -0.53 -4.54 121.20 115.99 3fga s ILE 395 Ca -0.08 -0.20 -0.12 0.00 -0.26 0.00 0.00 60.65 60.00 3fga s ILE 395 Cb 0.00 -2.96 0.03 0.00 1.25 0.00 0.00 42.46 40.78 3fga s ILE 395 CO 0.19 0.00 1.09 -0.83 0.24 0.00 0.00 174.94 175.63 3fga s GLY 396 N -4.61 1.77 0.32 6.27 0.00 -1.26 -4.62 107.32 105.20 3fga s GLY 396 Ca 0.63 0.29 0.03 0.00 0.00 0.00 0.00 44.72 45.66 3fga s GLY 396 CO 0.47 0.63 1.88 1.19 0.00 0.00 0.00 173.10 177.27 3fga h ILE 397 N -0.79 1.20 0.06 0.90 6.09 -1.95 -0.26 117.51 122.75 3fga h ILE 397 Ca -0.44 -0.72 0.02 0.00 -1.37 0.00 0.00 64.86 62.35 3fga h ILE 397 Cb 1.23 0.77 -0.03 0.00 0.47 0.00 0.00 36.82 39.26 3fga h ILE 397 CO 0.53 0.26 -0.19 -0.09 -3.07 0.00 0.00 178.15 175.59 3fga h ARG 398 N 0.63 -0.32 -0.83 2.19 9.65 -1.95 -2.12 114.38 121.63 3fga h ARG 398 Ca 0.14 0.02 -0.03 0.00 -1.10 0.00 0.00 59.98 59.01 3fga h ARG 398 Cb 0.26 0.07 -0.04 0.00 -1.39 0.00 0.00 29.97 28.88 3fga h ARG 398 CO -0.00 -0.22 0.39 1.96 2.80 0.00 0.00 179.97 184.90 3fga h GLN 399 N -0.34 1.20 0.09 0.20 1.08 -1.89 -3.06 115.11 112.39 3fga h GLN 399 Ca 0.04 -0.18 0.02 0.00 -1.45 0.00 0.00 58.65 57.08 3fga h GLN 399 Cb 0.38 -0.21 -0.04 0.00 -0.05 0.00 0.00 27.48 27.55 3fga h GLN 399 CO -0.13 0.93 -0.34 1.25 -0.95 0.00 0.00 178.83 179.58 3fga h LEU 400 N 1.18 -1.01 -0.65 1.46 7.12 -0.84 -0.35 115.31 122.22 3fga h LEU 400 Ca 0.28 0.12 0.00 0.00 0.13 0.00 0.00 57.88 58.41 3fga h LEU 400 Cb 0.14 0.39 0.00 0.00 -0.53 0.00 0.00 40.66 40.66 3fga h LEU 400 CO -0.03 -0.42 0.00 -1.54 -0.13 0.00 0.00 178.44 176.31 3fga n SER 401 N -5.43 0.42 -0.10 1.25 3.41 -0.81 -0.13 113.62 112.23 3fga n SER 401 Ca -0.06 0.63 -0.23 0.00 -0.26 0.00 0.00 58.87 58.95 3fga n SER 401 Cb 0.34 -0.71 -0.11 0.00 -0.26 0.00 0.00 64.21 63.47 3fga n SER 401 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 3fga n GLN 402 N -2.00 0.58 0.01 4.33 7.27 -0.83 -4.17 117.38 122.57 3fga n GLN 402 Ca 0.01 0.50 -0.19 0.00 0.07 0.00 0.00 57.00 57.39 3fga n GLN 402 Cb 0.14 -1.70 -0.14 0.00 2.41 0.00 0.00 30.24 30.95 3fga n GLN 402 CO 0.00 0.00 0.00 0.77 0.07 0.00 0.00 177.06 177.90 3fga h SER 403 N -0.91 0.32 0.00 1.69 0.02 -0.66 -3.43 113.55 110.58 3fga h SER 403 Ca -0.42 -0.93 -0.20 0.00 -0.84 0.00 0.00 61.79 59.40 3fga h SER 403 Cb 1.42 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 63.82 3fga h SER 403 CO -0.23 1.34 -1.75 0.18 -1.14 0.00 0.00 176.83 175.23 3fga n LEU 404 N -4.23 0.10 -0.21 5.07 4.77 0.82 -4.66 117.00 118.66 3fga n LEU 404 Ca -0.15 -0.00 0.02 0.00 -0.03 0.00 0.00 56.01 55.84 3fga n LEU 404 Cb 0.74 0.24 0.12 0.00 -2.33 0.00 0.00 43.42 42.20 3fga n LEU 404 CO 0.42 0.28 0.87 0.25 -1.33 0.00 0.00 177.39 177.89 3fga h LEU 405 N 0.00 -0.16 -1.01 2.23 7.12 -1.61 -0.83 115.31 121.05 3fga h LEU 405 Ca -0.30 0.14 0.13 0.00 0.13 0.00 0.00 57.88 57.98 3fga h LEU 405 Cb 1.66 0.23 -0.09 0.00 -0.53 0.00 0.00 40.66 41.94 3fga h LEU 405 CO 0.01 -0.07 0.63 -0.65 -0.13 0.00 0.00 178.44 178.23 3fga h PRO 406 N 0.17 0.95 0.00 5.25 0.11 -1.83 0.13 132.00 136.79 3fga h PRO 406 Ca 0.34 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.30 3fga h PRO 406 Cb 0.54 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 3fga h PRO 406 CO -0.50 0.63 -0.45 0.00 -0.21 0.00 0.00 178.00 177.47 3fga h ALA 407 N 1.55 1.18 -0.14 -0.75 0.00 -1.48 -2.76 119.26 116.87 3fga h ALA 407 Ca 0.51 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 3fga h ALA 407 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3fga h ALA 407 CO -0.28 0.56 -0.47 0.82 0.00 0.00 0.00 179.25 179.89 3fga h ILE 408 N 0.00 1.35 -0.66 0.00 2.04 0.26 -2.56 117.51 117.94 3fga h ILE 408 Ca -0.00 -1.75 0.06 0.00 1.00 0.00 0.00 64.86 64.16 3fga h ILE 408 Cb 0.83 2.08 -0.04 0.00 -0.74 0.00 0.00 36.82 38.95 3fga h ILE 408 CO 0.06 0.53 0.43 0.58 0.00 0.00 0.00 178.15 179.75 3fga h VAL 409 N 0.18 1.03 -0.42 1.67 2.07 -1.00 -1.03 116.25 118.75 3fga h VAL 409 Ca -0.02 -0.24 -0.11 0.00 0.82 0.00 0.00 66.70 67.15 3fga h VAL 409 Cb 1.09 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 3fga h VAL 409 CO 0.10 0.13 -0.20 -0.08 0.02 0.00 0.00 177.57 177.54 3fga h GLU 410 N 0.69 0.82 0.00 1.57 4.81 -1.32 -2.86 114.58 118.29 3fga h GLU 410 Ca 0.28 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3fga h GLU 410 Cb 0.22 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.56 3fga h GLU 410 CO -0.09 0.95 0.00 1.28 -0.73 0.00 0.00 179.01 180.42 3fga n LEU 411 N -4.12 0.49 0.25 1.64 4.77 -0.48 -2.64 117.00 116.91 3fga n LEU 411 Ca 0.00 0.55 0.12 0.00 -0.03 0.00 0.00 56.01 56.66 3fga n LEU 411 Cb 0.42 -0.41 0.67 0.00 -2.33 0.00 0.00 43.42 41.78 3fga n LEU 411 CO 0.45 -0.16 0.94 0.00 -1.33 0.00 0.00 177.39 177.29 3fga h ALA 412 N 2.66 1.23 -0.39 -1.18 0.00 -1.08 -2.46 119.26 118.05 3fga h ALA 412 Ca 0.00 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.55 3fga h ALA 412 Cb 0.60 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 18.22 3fga h ALA 412 CO 0.00 0.18 -0.19 -0.85 0.00 0.00 0.00 179.25 178.38 3fga n GLU 413 N -3.59 2.07 -0.91 0.00 0.00 -1.08 -4.84 120.64 112.29 3fga n GLU 413 Ca -0.01 -3.35 -0.32 0.00 0.00 0.00 0.00 57.16 53.48 3fga n GLU 413 Cb 0.27 -1.88 0.14 0.00 0.00 0.00 0.00 31.44 29.98 3fga n GLU 413 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 3fga s ASP 414 N -2.75 3.33 0.17 -1.84 2.15 -0.92 -4.96 116.67 111.84 3fga s ASP 414 Ca 0.46 2.22 -0.07 0.00 0.43 0.00 0.00 52.55 55.58 3fga s ASP 414 Cb 0.41 -2.57 0.04 0.00 -0.30 0.00 0.00 42.92 40.49 3fga s ASP 414 CO -0.01 -2.83 1.49 0.00 -0.17 0.00 0.00 175.17 173.64 3fga h ALA 415 N -1.43 0.63 -2.79 3.66 0.00 -1.94 -3.44 119.26 113.95 3fga h ALA 415 Ca -0.44 -0.49 -0.60 0.00 0.00 0.00 0.00 54.91 53.38 3fga h ALA 415 Cb 1.27 -0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.86 3fga h ALA 415 CO 0.44 0.68 -0.12 0.15 0.00 0.00 0.00 179.25 180.40 3fga s LYS 416 N -4.18 4.19 0.47 0.00 -0.14 -1.26 -4.99 119.74 113.84 3fga s LYS 416 Ca -0.09 0.32 0.19 0.00 -1.36 0.00 0.00 55.97 55.02 3fga s LYS 416 Cb 0.11 -3.54 1.14 0.00 -1.68 0.00 0.00 37.83 33.86 3fga s LYS 416 CO 0.86 -0.07 2.01 0.11 -0.76 0.00 0.00 175.35 177.50 3fga h TRP 417 N 7.37 0.00 -0.13 3.18 5.08 -2.00 -1.67 115.95 127.78 3fga h TRP 417 Ca -0.35 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 59.55 3fga h TRP 417 Cb 1.16 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.31 3fga h TRP 417 CO 0.68 0.18 -0.20 0.00 -1.28 0.00 0.00 178.44 177.82 3fga h ARG 418 N 0.00 0.22 -0.12 0.12 3.08 -1.97 0.27 114.38 115.98 3fga h ARG 418 Ca -0.00 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 3fga h ARG 418 Cb 0.35 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 3fga h ARG 418 CO 0.02 0.42 -0.09 0.28 -1.07 0.00 0.00 179.97 179.53 3fga h VAL 419 N 0.20 1.34 -0.52 2.04 2.07 -1.69 -1.75 116.25 117.96 3fga h VAL 419 Ca 0.04 -1.21 0.10 0.00 0.82 0.00 0.00 66.70 66.45 3fga h VAL 419 Cb 0.48 1.88 -0.08 0.00 -1.52 0.00 0.00 31.29 32.05 3fga h VAL 419 CO 0.03 0.35 0.06 0.03 0.02 0.00 0.00 177.57 178.06 3fga h ARG 420 N -0.11 0.18 -0.92 1.57 3.08 -0.96 -2.16 114.38 115.06 3fga h ARG 420 Ca 0.02 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.09 3fga h ARG 420 Cb 0.59 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.55 3fga h ARG 420 CO 0.02 0.12 0.60 1.25 -1.07 0.00 0.00 179.97 180.89 3fga h LEU 421 N 0.19 1.01 -0.67 3.04 5.85 -0.42 -1.99 115.31 122.31 3fga h LEU 421 Ca 0.26 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 59.06 3fga h LEU 421 Cb 0.38 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.11 3fga h LEU 421 CO -0.38 0.70 0.31 0.00 -0.34 0.00 0.00 178.44 178.73 3fga h ALA 422 N 1.37 0.91 -0.55 1.25 0.00 -0.66 -0.75 119.26 120.83 3fga h ALA 422 Ca 0.36 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.22 3fga h ALA 422 Cb -0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3fga h ALA 422 CO -0.11 -0.10 -0.08 0.82 0.00 0.00 0.00 179.25 179.78 3fga h ILE 423 N 0.53 1.27 -0.24 0.00 1.08 -1.19 -3.11 117.51 115.84 3fga h ILE 423 Ca 0.34 -1.23 -0.01 0.00 -0.39 0.00 0.00 64.86 63.57 3fga h ILE 423 Cb 0.38 0.93 -0.01 0.00 -3.07 0.00 0.00 36.82 35.05 3fga h ILE 423 CO -0.28 0.44 0.12 0.40 -0.69 0.00 0.00 178.15 178.13 3fga h ILE 424 N 0.91 1.13 0.00 -0.67 2.04 -0.59 -1.08 117.51 119.24 3fga h ILE 424 Ca 0.15 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.64 3fga h ILE 424 Cb 0.64 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 3fga h ILE 424 CO 0.04 0.13 0.00 -0.62 0.00 0.00 0.00 178.15 177.70 3fga n GLU 425 N -4.84 0.06 -0.01 2.37 1.02 -0.38 -1.88 120.64 116.97 3fga n GLU 425 Ca -0.03 0.27 0.07 0.00 -0.02 0.00 0.00 57.16 57.45 3fga n GLU 425 Cb 0.09 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 29.90 3fga n GLU 425 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 3fga n TYR 426 N -1.42 0.00 -0.13 -0.32 4.19 -0.88 -4.60 117.16 113.99 3fga n TYR 426 Ca 0.03 0.00 -0.05 0.00 3.31 0.00 0.00 57.90 61.20 3fga n TYR 426 Cb 0.11 -0.32 0.02 0.00 0.49 0.00 0.00 39.34 39.63 3fga n TYR 426 CO 0.00 0.00 0.00 0.52 0.91 0.00 0.00 176.86 178.29 3fga h MET 427 N 0.00 -0.08 -0.32 2.98 2.86 -0.48 -2.11 114.93 117.78 3fga h MET 427 Ca -0.00 0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.70 3fga h MET 427 Cb 0.66 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.28 3fga h MET 427 CO 0.00 -0.05 0.01 -1.35 1.06 0.00 0.00 176.91 176.57 3fga h PRO 428 N -0.09 0.10 0.15 -0.22 0.11 -1.81 0.28 132.00 130.52 3fga h PRO 428 Ca 0.21 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.31 3fga h PRO 428 Cb 0.41 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.49 3fga h PRO 428 CO -0.49 0.06 -0.09 1.25 -0.21 0.00 0.00 178.00 178.52 3fga h LEU 429 N 0.10 -0.23 -0.59 2.35 5.85 -1.84 -2.28 115.31 118.67 3fga h LEU 429 Ca 0.15 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.93 3fga h LEU 429 Cb 0.20 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 3fga h LEU 429 CO -0.25 -0.15 0.34 0.25 -0.34 0.00 0.00 178.44 178.29 3fga h LEU 430 N -0.24 0.52 -0.29 2.25 6.46 -0.86 -2.75 115.31 120.41 3fga h LEU 430 Ca -0.01 0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 3fga h LEU 430 Cb 0.20 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.02 3fga h LEU 430 CO 0.02 0.35 0.16 0.00 -0.62 0.00 0.00 178.44 178.35 3fga h ALA 431 N 1.29 0.37 -0.96 1.25 0.00 -0.38 -1.87 119.26 118.97 3fga h ALA 431 Ca 0.25 -0.06 0.27 0.00 0.00 0.00 0.00 54.91 55.38 3fga h ALA 431 Cb 0.10 -0.12 -0.14 0.00 0.00 0.00 0.00 17.79 17.64 3fga h ALA 431 CO -0.14 -0.11 0.46 0.78 0.00 0.00 0.00 179.25 180.24 3fga h GLY 432 N 0.36 1.79 2.00 0.00 0.00 -1.13 0.61 103.07 106.70 3fga h GLY 432 Ca 0.10 -0.19 -0.19 0.00 0.00 0.00 0.00 47.33 47.05 3fga h GLY 432 CO -0.02 -0.39 -0.91 1.46 0.00 0.00 0.00 176.54 176.68 3fga h GLN 433 N 0.35 0.00 0.15 4.80 4.20 -1.12 -3.27 115.11 120.22 3fga h GLN 433 Ca 0.65 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 59.07 3fga h GLN 433 Cb 1.37 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.17 3fga h GLN 433 CO -0.59 0.91 -1.29 -0.07 -0.67 0.00 0.00 178.83 177.12 3fga h LEU 434 N 0.00 0.51 0.00 1.46 3.38 -0.63 -3.50 115.31 116.53 3fga h LEU 434 Ca -0.01 -0.55 0.00 0.00 0.09 0.00 0.00 57.88 57.41 3fga h LEU 434 Cb 1.65 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.24 3fga h LEU 434 CO 0.12 1.43 0.00 0.61 0.09 0.00 0.00 178.44 180.69 3fga n GLY 435 N 1.57 0.63 0.19 0.83 0.00 0.13 -4.58 105.19 103.96 3fga n GLY 435 Ca -0.10 -1.71 -0.08 0.00 0.00 0.00 0.00 46.02 44.13 3fga n GLY 435 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3fga h VAL 436 N 0.00 1.13 -0.20 1.61 2.07 -1.91 0.12 116.25 119.07 3fga h VAL 436 Ca 0.00 -0.28 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 3fga h VAL 436 Cb 0.00 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 3fga h VAL 436 CO 0.00 0.13 -0.08 1.05 0.02 0.00 0.00 177.57 178.69 3fga h GLU 437 N 0.57 0.30 0.15 1.57 9.09 -1.97 0.24 114.58 124.53 3fga h GLU 437 Ca 0.16 -0.06 -0.01 0.00 0.05 0.00 0.00 59.36 59.49 3fga h GLU 437 Cb -0.02 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 27.04 3fga h GLU 437 CO -0.03 0.40 -0.07 0.35 0.05 0.00 0.00 179.01 179.71 3fga h PHE 438 N 0.29 -0.18 -0.48 2.06 3.04 -1.71 -3.17 116.94 116.79 3fga h PHE 438 Ca 0.06 -0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.06 3fga h PHE 438 Cb 0.34 0.06 -0.08 0.00 2.56 0.00 0.00 35.95 38.83 3fga h PHE 438 CO 0.01 0.14 -0.46 0.35 -2.02 0.00 0.00 178.31 176.33 3fga h PHE 439 N -0.98 -1.43 -0.13 0.41 3.04 -0.61 0.14 116.94 117.38 3fga h PHE 439 Ca -0.02 0.08 0.00 0.00 3.98 0.00 0.00 57.97 62.01 3fga h PHE 439 Cb 0.41 0.69 0.00 0.00 2.56 0.00 0.00 35.95 39.61 3fga h PHE 439 CO 0.07 -0.37 0.00 -0.40 -2.02 0.00 0.00 178.31 175.59 3fga n ASP 440 N -4.85 1.05 -0.13 0.41 5.68 0.06 0.12 116.55 118.89 3fga n ASP 440 Ca -0.01 -2.05 -0.20 0.00 -0.50 0.00 0.00 54.79 52.03 3fga n ASP 440 Cb 0.26 -0.22 -0.12 0.00 -1.14 0.00 0.00 41.12 39.90 3fga n ASP 440 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 3fga n GLU 441 N -0.04 0.65 -0.01 0.11 2.13 -0.58 -4.61 120.64 118.29 3fga n GLU 441 Ca 0.05 0.17 0.07 0.00 0.66 0.00 0.00 57.16 58.11 3fga n GLU 441 Cb 0.20 -1.52 -0.11 0.00 0.27 0.00 0.00 31.44 30.28 3fga n GLU 441 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3fga n LYS 442 N -3.39 0.75 0.00 5.31 5.02 -0.07 -4.77 118.16 121.01 3fga n LYS 442 Ca -0.47 -0.11 0.00 0.00 -2.02 0.00 0.00 58.31 55.71 3fga n LYS 442 Cb 0.98 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 34.66 3fga n LYS 442 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3fga n LEU 443 N -1.90 0.23 0.45 -0.35 4.32 0.33 -4.84 117.00 115.24 3fga n LEU 443 Ca -0.02 -0.38 -0.18 0.00 -0.02 0.00 0.00 56.01 55.41 3fga n LEU 443 Cb 0.36 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 42.08 3fga n LEU 443 CO 0.31 0.06 0.47 -1.13 -1.22 0.00 0.00 177.39 175.88 3fga h ASN 444 N 0.00 -0.97 -0.96 -1.43 -1.24 -1.69 -2.91 115.58 106.37 3fga h ASN 444 Ca 0.00 0.03 0.20 0.00 0.71 0.00 0.00 56.30 57.24 3fga h ASN 444 Cb 0.10 0.25 -0.11 0.00 0.73 0.00 0.00 38.32 39.29 3fga h ASN 444 CO 0.00 -0.64 0.55 0.28 -1.29 0.00 0.00 177.43 176.33 3fga h SER 445 N -1.26 0.65 -0.97 1.15 0.02 -1.90 -0.10 113.55 111.14 3fga h SER 445 Ca -0.12 0.11 0.06 0.00 -0.84 0.00 0.00 61.79 61.01 3fga h SER 445 Cb 0.88 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 63.36 3fga h SER 445 CO 0.19 0.18 0.62 0.25 -1.14 0.00 0.00 176.83 176.94 3fga h LEU 446 N 0.64 1.00 -0.21 5.07 5.85 -1.87 0.14 115.31 125.94 3fga h LEU 446 Ca 0.57 0.01 -0.22 0.00 0.84 0.00 0.00 57.88 59.08 3fga h LEU 446 Cb 0.96 -0.21 0.01 0.00 0.37 0.00 0.00 40.66 41.79 3fga h LEU 446 CO -0.42 0.65 -0.82 0.00 -0.34 0.00 0.00 178.44 177.50 3fga h MET 448 N 0.41 0.62 -0.94 0.00 2.86 -0.67 -2.87 114.93 114.35 3fga h MET 448 Ca -0.06 -0.09 0.16 0.00 -2.06 0.00 0.00 59.70 57.64 3fga h MET 448 Cb 1.44 -0.11 -0.10 0.00 0.06 0.00 0.00 31.60 32.89 3fga h MET 448 CO 0.16 0.54 0.55 0.00 1.06 0.00 0.00 176.91 179.21 3fga h ALA 449 N 1.06 1.48 -0.97 6.32 0.00 -0.77 -1.22 119.26 125.15 3fga h ALA 449 Ca 0.15 0.07 0.16 0.00 0.00 0.00 0.00 54.91 55.28 3fga h ALA 449 Cb 0.12 -0.09 -0.09 0.00 0.00 0.00 0.00 17.79 17.73 3fga h ALA 449 CO -0.02 -0.00 0.61 -1.49 0.00 0.00 0.00 179.25 178.35 3fga h TRP 450 N 0.76 1.00 0.00 0.00 6.55 -1.44 0.59 115.95 123.42 3fga h TRP 450 Ca 0.52 0.03 -0.00 0.00 0.95 0.00 0.00 58.89 60.39 3fga h TRP 450 Cb 0.71 -0.31 -0.00 0.00 -0.86 0.00 0.00 29.16 28.70 3fga h TRP 450 CO -0.04 0.32 -0.00 -0.07 -1.05 0.00 0.00 178.44 177.60 3fga h LEU 451 N 0.81 0.00 -3.25 -4.49 3.38 -1.26 -2.34 115.31 108.16 3fga h LEU 451 Ca 0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.48 3fga h LEU 451 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 3fga h LEU 451 CO -0.29 0.00 0.00 0.55 0.09 0.00 0.00 178.44 178.80 3fga n VAL 452 N -3.15 2.21 -2.59 1.22 3.14 0.19 -4.81 118.33 114.54 3fga n VAL 452 Ca -0.02 -1.76 -0.35 0.00 -2.96 0.00 0.00 64.34 59.25 3fga n VAL 452 Cb 0.11 -0.19 -0.04 0.00 -1.06 0.00 0.00 33.84 32.66 3fga n VAL 452 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 3fga s ASP 453 N -1.75 6.60 0.40 6.55 2.15 -0.88 -4.98 116.67 124.76 3fga s ASP 453 Ca 0.42 1.93 0.07 0.00 0.43 0.00 0.00 52.55 55.39 3fga s ASP 453 Cb 0.33 -2.57 0.82 0.00 -0.30 0.00 0.00 42.92 41.21 3fga s ASP 453 CO 0.10 -0.60 2.03 1.12 -0.17 0.00 0.00 175.17 177.65 3fga h HIS 454 N 1.97 0.50 -3.26 -5.34 2.07 -1.94 -3.43 115.15 105.72 3fga h HIS 454 Ca -0.49 0.00 -0.57 0.00 -2.85 0.00 0.00 60.37 56.46 3fga h HIS 454 Cb 1.21 -0.17 -0.05 0.00 2.57 0.00 0.00 27.41 30.97 3fga h HIS 454 CO 0.58 0.35 -0.04 0.14 -3.07 0.00 0.00 177.93 175.89 3fga s VAL 455 N -5.38 4.89 0.09 6.12 -7.23 -1.26 -4.99 120.40 112.65 3fga s VAL 455 Ca -0.08 1.18 -0.23 0.00 -1.81 0.00 0.00 61.98 61.04 3fga s VAL 455 Cb 0.17 -3.90 -0.14 0.00 0.56 0.00 0.00 36.38 33.08 3fga s VAL 455 CO 0.74 0.46 1.73 0.22 -0.31 0.00 0.00 175.10 177.94 3fga h TYR 456 N 5.32 -0.04 -0.94 2.82 5.03 -2.00 -2.52 116.97 124.64 3fga h TYR 456 Ca -0.47 0.00 0.23 0.00 2.58 0.00 0.00 58.73 61.08 3fga h TYR 456 Cb 1.20 0.02 -0.13 0.00 1.55 0.00 0.00 36.73 39.38 3fga h TYR 456 CO 0.66 -0.02 0.47 0.00 -1.32 0.00 0.00 178.16 177.95 3fga h ALA 457 N 0.97 1.58 -0.25 1.82 0.00 -1.96 0.52 119.26 121.94 3fga h ALA 457 Ca 0.01 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3fga h ALA 457 Cb 0.04 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3fga h ALA 457 CO -0.02 -0.33 0.04 0.82 0.00 0.00 0.00 179.25 179.76 3fga h ILE 458 N 0.46 1.23 -0.07 0.00 1.08 -1.85 0.05 117.51 118.41 3fga h ILE 458 Ca 0.60 -0.78 0.04 0.00 -0.39 0.00 0.00 64.86 64.33 3fga h ILE 458 Cb 1.15 1.26 -0.05 0.00 -3.07 0.00 0.00 36.82 36.12 3fga h ILE 458 CO -0.52 0.25 -0.20 0.03 -0.69 0.00 0.00 178.15 177.02 3fga h ARG 459 N 0.22 -0.27 -0.16 2.37 3.08 -0.21 -1.30 114.38 118.11 3fga h ARG 459 Ca 0.08 0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.19 3fga h ARG 459 Cb 0.33 0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.38 3fga h ARG 459 CO 0.01 -0.18 -0.35 1.49 -1.07 0.00 0.00 179.97 179.87 3fga h GLU 460 N -0.28 -0.39 -0.77 0.04 4.81 0.05 -1.77 114.58 116.27 3fga h GLU 460 Ca 0.08 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.36 3fga h GLU 460 Cb 0.40 0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.82 3fga h GLU 460 CO -0.23 -0.26 0.49 0.00 -0.73 0.00 0.00 179.01 178.28 3fga h ALA 461 N 0.38 1.00 0.00 2.92 0.00 -0.79 -1.33 119.26 121.44 3fga h ALA 461 Ca 0.10 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3fga h ALA 461 Cb 0.57 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 3fga h ALA 461 CO -0.38 0.31 -0.03 0.00 0.00 0.00 0.00 179.25 179.15 3fga h ALA 462 N 1.31 1.04 0.00 0.00 0.00 -0.59 -1.58 119.26 119.45 3fga h ALA 462 Ca 0.30 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 3fga h ALA 462 Cb -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3fga h ALA 462 CO -0.10 0.04 -0.00 1.15 0.00 0.00 0.00 179.25 180.33 3fga h THR 463 N 0.00 1.61 -0.13 0.00 2.02 -0.40 -3.01 112.91 112.99 3fga h THR 463 Ca -0.00 -1.87 -0.13 0.00 0.77 0.00 0.00 66.41 65.17 3fga h THR 463 Cb 0.34 2.88 -0.01 0.00 -1.74 0.00 0.00 68.15 69.61 3fga h THR 463 CO 0.00 0.48 -0.49 0.77 0.37 0.00 0.00 175.52 176.66 3fga h SER 464 N -0.81 0.37 -1.15 4.18 4.64 -1.34 -1.98 113.55 117.46 3fga h SER 464 Ca -0.00 -0.18 0.37 0.00 -0.47 0.00 0.00 61.79 61.51 3fga h SER 464 Cb 0.79 -0.11 -0.13 0.00 -0.31 0.00 0.00 62.40 62.65 3fga h SER 464 CO 0.00 0.80 0.71 -1.13 -0.87 0.00 0.00 176.83 176.35 3fga h ASN 465 N 0.27 0.36 -0.72 4.97 -0.00 -1.37 0.67 115.58 119.78 3fga h ASN 465 Ca 0.01 0.15 -0.00 0.00 -0.00 0.00 0.00 56.30 56.46 3fga h ASN 465 Cb 0.96 0.12 -0.03 0.00 -0.00 0.00 0.00 38.32 39.37 3fga h ASN 465 CO 0.08 -0.14 0.45 -0.07 -0.00 0.00 0.00 177.43 177.75 3fga h LEU 466 N 0.20 0.85 -0.80 0.34 4.07 -1.21 -1.72 115.31 117.05 3fga h LEU 466 Ca 0.76 -0.05 -0.09 0.00 0.08 0.00 0.00 57.88 58.58 3fga h LEU 466 Cb 2.10 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 43.60 3fga h LEU 466 CO -0.47 0.65 -0.07 0.50 -1.08 0.00 0.00 178.44 177.96 3fga h LYS 467 N 0.98 0.83 -0.26 1.13 3.11 -0.94 -1.80 116.57 119.61 3fga h LYS 467 Ca 0.26 -0.26 -0.12 0.00 -2.81 0.00 0.00 60.65 57.71 3fga h LYS 467 Cb -0.06 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.08 3fga h LYS 467 CO -0.05 0.88 -0.35 0.87 -2.81 0.00 0.00 179.45 177.99 3fga h LYS 468 N 0.76 0.57 0.21 1.90 1.57 -1.17 -2.54 116.57 117.86 3fga h LYS 468 Ca 0.13 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 3fga h LYS 468 Cb 0.56 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.87 3fga h LYS 468 CO 0.03 0.84 -0.10 -0.07 -0.57 0.00 0.00 179.45 179.59 3fga h LEU 469 N 0.48 -0.23 -2.13 2.94 4.07 -0.96 -2.86 115.31 116.62 3fga h LEU 469 Ca 0.05 -0.21 0.08 0.00 0.08 0.00 0.00 57.88 57.88 3fga h LEU 469 Cb 0.84 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.63 3fga h LEU 469 CO 0.07 0.10 0.25 0.58 -1.08 0.00 0.00 178.44 178.35 3fga h VAL 470 N -0.58 0.58 0.00 1.22 2.07 -1.33 0.54 116.25 118.74 3fga h VAL 470 Ca -0.03 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 3fga h VAL 470 Cb 0.43 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 3fga h VAL 470 CO 0.05 0.00 -0.24 -0.33 0.02 0.00 0.00 177.57 177.07 3fga h GLU 471 N 0.00 0.00 0.00 1.57 5.08 -1.22 0.33 114.58 120.34 3fga h GLU 471 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3fga h GLU 471 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 3fga h GLU 471 CO -0.00 0.24 -1.71 0.36 -1.00 0.00 0.00 179.01 176.90 3fga n LYS 472 N -3.37 0.62 -0.00 2.33 0.00 -0.09 -4.57 118.16 113.08 3fga n LYS 472 Ca 0.00 -0.15 0.08 0.00 -0.00 0.00 0.00 58.31 58.25 3fga n LYS 472 Cb 0.45 -1.41 -0.11 0.00 -0.00 0.00 0.00 35.03 33.96 3fga n LYS 472 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 3fga n PHE 473 N -2.04 0.00 -0.03 5.58 3.72 -0.01 -5.05 117.46 119.61 3fga n PHE 473 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 3fga n PHE 473 Cb 0.44 -0.13 -0.00 0.00 -0.94 0.00 0.00 39.48 38.85 3fga n PHE 473 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fga n GLY 474 N 1.44 -2.30 0.27 1.37 0.00 0.12 -4.39 105.19 101.69 3fga n GLY 474 Ca 0.01 -1.46 0.16 0.00 0.00 0.00 0.00 46.02 44.72 3fga n GLY 474 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3fga h LYS 475 N -0.03 0.00 0.00 1.61 2.10 -1.83 -3.05 116.57 115.37 3fga h LYS 475 Ca -0.00 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.50 3fga h LYS 475 Cb 0.03 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.34 3fga h LYS 475 CO 0.00 0.07 -1.20 1.05 -2.00 0.00 0.00 179.45 177.37 3fga h GLU 476 N 0.00 0.00 -0.70 0.07 9.09 -1.95 -1.84 114.58 119.25 3fga h GLU 476 Ca -0.00 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.35 3fga h GLU 476 Cb 0.47 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.54 3fga h GLU 476 CO 0.01 0.33 0.19 2.35 0.05 0.00 0.00 179.01 181.94 3fga h TRP 477 N 0.00 1.15 -0.06 2.06 7.01 -1.74 -2.89 115.95 121.48 3fga h TRP 477 Ca -0.12 -0.12 0.01 0.00 2.11 0.00 0.00 58.89 60.76 3fga h TRP 477 Cb 1.52 -0.33 -0.01 0.00 -2.10 0.00 0.00 29.16 28.25 3fga h TRP 477 CO 0.00 0.92 0.01 0.00 -2.79 0.00 0.00 178.44 176.58 3fga h ALA 478 N 1.15 0.06 -0.11 2.65 0.00 -1.45 -1.07 119.26 120.49 3fga h ALA 478 Ca 0.22 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.18 3fga h ALA 478 Cb 0.33 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3fga h ALA 478 CO -0.00 -0.46 0.08 1.25 0.00 0.00 0.00 179.25 180.11 3fga h HIS 479 N 0.04 0.00 0.00 0.00 -0.00 -1.22 -0.74 115.15 113.23 3fga h HIS 479 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 3fga h HIS 479 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.43 3fga h HIS 479 CO -0.10 0.00 -1.53 0.00 -0.00 0.00 0.00 177.93 176.29 3fga n ALA 480 N -2.52 3.31 0.00 5.26 0.00 -1.10 -4.44 120.51 121.03 3fga n ALA 480 Ca -0.00 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.95 3fga n ALA 480 Cb 0.20 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 18.98 3fga n ALA 480 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3fga n THR 481 N -1.92 0.00 -0.03 0.00 -1.04 -0.42 -4.89 114.28 105.98 3fga n THR 481 Ca -0.01 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.98 3fga n THR 481 Cb 0.43 -1.14 -0.01 0.00 -1.82 0.00 0.00 70.33 67.79 3fga n THR 481 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3fga n ILE 482 N -2.79 0.60 -0.33 12.58 2.08 -0.39 -4.60 119.36 126.51 3fga n ILE 482 Ca 0.00 0.38 -0.08 0.00 0.56 0.00 0.00 62.75 63.61 3fga n ILE 482 Cb 0.43 -1.87 -0.06 0.00 -0.75 0.00 0.00 39.64 37.39 3fga n ILE 482 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 3fga n ILE 483 N -3.25 -0.52 -0.06 1.39 2.08 -0.56 -1.84 119.36 116.59 3fga n ILE 483 Ca -0.04 1.89 -0.02 0.00 0.56 0.00 0.00 62.75 65.15 3fga n ILE 483 Cb 0.13 -2.36 0.24 0.00 -0.75 0.00 0.00 39.64 36.91 3fga n ILE 483 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 3fga h PRO 484 N 0.00 0.67 -0.65 0.38 0.11 -1.83 0.21 132.00 130.90 3fga h PRO 484 Ca 0.15 -0.14 -0.06 0.00 0.11 0.00 0.00 66.00 66.06 3fga h PRO 484 Cb 0.34 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.33 3fga h PRO 484 CO -0.74 0.65 0.18 0.87 -0.21 0.00 0.00 178.00 178.75 3fga h LYS 485 N 0.65 1.02 -0.55 1.05 1.79 -1.62 -0.50 116.57 118.40 3fga h LYS 485 Ca 0.14 -0.23 0.05 0.00 -2.18 0.00 0.00 60.65 58.42 3fga h LYS 485 Cb 0.32 -0.14 -0.05 0.00 -1.58 0.00 0.00 32.23 30.78 3fga h LYS 485 CO 0.01 0.90 0.30 0.28 -1.08 0.00 0.00 179.45 179.86 3fga h VAL 486 N 0.95 0.97 0.00 0.50 2.07 -0.76 -2.47 116.25 117.51 3fga h VAL 486 Ca 0.21 -0.20 -0.12 0.00 0.82 0.00 0.00 66.70 67.41 3fga h VAL 486 Cb 0.32 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 3fga h VAL 486 CO -0.00 0.10 -0.57 -0.07 0.02 0.00 0.00 177.57 177.05 3fga h LEU 487 N 0.57 0.00 -2.00 2.57 3.38 -0.77 -2.74 115.31 116.33 3fga h LEU 487 Ca 0.24 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.37 3fga h LEU 487 Cb 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3fga h LEU 487 CO -0.15 0.57 0.40 0.00 0.09 0.00 0.00 178.44 179.34 3fga h ALA 488 N 1.43 2.52 0.00 1.53 0.00 -0.61 0.45 119.26 124.58 3fga h ALA 488 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3fga h ALA 488 Cb 1.15 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3fga h ALA 488 CO 0.07 -0.68 0.00 -1.33 0.00 0.00 0.00 179.25 177.32 3fga n MET 489 N -4.37 0.07 0.00 0.00 2.81 -1.03 -2.90 117.12 111.69 3fga n MET 489 Ca 0.10 0.22 0.13 0.00 -1.81 0.00 0.00 57.70 56.34 3fga n MET 489 Cb 0.63 -1.50 0.66 0.00 -0.71 0.00 0.00 33.22 32.29 3fga n MET 489 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3fga n SER 490 N -1.42 0.00 -0.54 7.83 3.41 0.15 -2.68 113.62 120.36 3fga n SER 490 Ca 0.05 -0.09 0.05 0.00 -0.26 0.00 0.00 58.87 58.62 3fga n SER 490 Cb 0.14 -0.29 0.14 0.00 -0.26 0.00 0.00 64.21 63.95 3fga n SER 490 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fga n GLY 491 N 0.93 3.10 3.72 5.00 0.00 -1.14 -4.96 105.19 111.83 3fga n GLY 491 Ca 0.12 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 3fga n GLY 491 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3fga s ASP 492 N -1.23 6.53 0.64 1.61 3.68 -1.09 -4.88 116.67 121.93 3fga s ASP 492 Ca 0.22 2.68 0.31 0.00 2.13 0.00 0.00 52.55 57.89 3fga s ASP 492 Cb 0.14 -2.60 1.66 0.00 -1.45 0.00 0.00 42.92 40.68 3fga s ASP 492 CO 0.11 -0.86 1.98 1.55 0.13 0.00 0.00 175.17 178.08 3fga h PRO 493 N 6.72 0.00 -5.15 4.34 0.13 -1.95 -3.41 132.00 132.68 3fga h PRO 493 Ca -0.43 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.08 3fga h PRO 493 Cb 1.20 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.19 3fga h PRO 493 CO 0.92 0.00 -0.34 1.21 -0.23 0.00 0.00 178.00 179.56 3fga s ASN 494 N -4.87 6.22 0.61 1.44 3.04 -1.26 -4.98 114.94 115.13 3fga s ASN 494 Ca -0.04 0.24 0.32 0.00 0.04 0.00 0.00 52.86 53.42 3fga s ASN 494 Cb 0.12 -2.18 1.83 0.00 -1.54 0.00 0.00 41.25 39.48 3fga s ASN 494 CO 0.39 -0.09 2.18 0.10 -3.04 0.00 0.00 177.10 176.64 3fga h TYR 495 N 7.92 0.00 -0.22 0.43 -0.00 -2.00 -2.02 116.97 121.09 3fga h TYR 495 Ca -0.34 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.24 3fga h TYR 495 Cb 1.17 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.89 3fga h TYR 495 CO 0.73 0.00 -0.45 1.25 -0.00 0.00 0.00 178.16 179.69 3fga h LEU 496 N 0.00 0.60 0.00 0.10 5.85 -1.94 -2.06 115.31 117.87 3fga h LEU 496 Ca 0.04 -0.28 -0.25 0.00 0.84 0.00 0.00 57.88 58.23 3fga h LEU 496 Cb 0.27 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 3fga h LEU 496 CO -0.00 0.97 -1.37 0.45 -0.34 0.00 0.00 178.44 178.14 3fga h HIS 497 N 0.45 0.00 -0.94 1.25 3.86 -1.76 -3.30 115.15 114.72 3fga h HIS 497 Ca 0.03 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 3fga h HIS 497 Cb 0.96 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 29.39 3fga h HIS 497 CO 0.04 0.96 0.57 0.00 0.86 0.00 0.00 177.93 180.37 3fga h ARG 498 N 0.00 1.27 0.00 2.45 3.08 -1.27 -2.70 114.38 117.20 3fga h ARG 498 Ca -0.16 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 59.73 3fga h ARG 498 Cb 1.88 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 31.65 3fga h ARG 498 CO 0.10 0.88 -0.23 0.52 -1.07 0.00 0.00 179.97 180.17 3fga h MET 499 N 1.29 0.00 -0.73 0.04 2.86 -1.46 -2.29 114.93 114.64 3fga h MET 499 Ca 0.34 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 58.03 3fga h MET 499 Cb -0.07 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.54 3fga h MET 499 CO -0.06 0.23 0.44 1.15 1.06 0.00 0.00 176.91 179.72 3fga h THR 500 N 0.00 1.03 -0.95 2.22 2.02 -1.56 0.15 112.91 115.83 3fga h THR 500 Ca -0.00 -0.28 0.16 0.00 0.77 0.00 0.00 66.41 67.06 3fga h THR 500 Cb 0.52 0.14 -0.08 0.00 -1.74 0.00 0.00 68.15 66.99 3fga h THR 500 CO 0.03 0.15 0.60 0.74 0.37 0.00 0.00 175.52 177.41 3fga h THR 501 N 0.82 0.79 0.09 3.16 2.02 -1.42 0.15 112.91 118.52 3fga h THR 501 Ca 0.31 -0.25 -0.28 0.00 0.77 0.00 0.00 66.41 66.97 3fga h THR 501 Cb 0.13 0.01 0.02 0.00 -1.74 0.00 0.00 68.15 66.56 3fga h THR 501 CO -0.16 0.13 -1.17 -0.07 0.37 0.00 0.00 175.52 174.62 3fga h LEU 502 N 0.72 0.73 -1.13 2.58 4.07 -1.07 -2.47 115.31 118.75 3fga h LEU 502 Ca 0.50 -0.67 -0.08 0.00 0.08 0.00 0.00 57.88 57.71 3fga h LEU 502 Cb 0.81 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 3fga h LEU 502 CO -0.26 1.48 -0.28 -0.26 -1.08 0.00 0.00 178.44 178.04 3fga h PHE 503 N 0.24 0.29 -0.19 1.13 0.05 0.21 -0.44 116.94 118.23 3fga h PHE 503 Ca -0.15 -0.06 -0.07 0.00 3.82 0.00 0.00 57.97 61.51 3fga h PHE 503 Cb 1.84 -0.07 -0.00 0.00 2.00 0.00 0.00 35.95 39.72 3fga h PHE 503 CO 0.09 0.52 -0.16 0.00 -0.18 0.00 0.00 178.31 178.58 3fga h ILE 505 N 0.11 1.19 -0.94 0.00 2.04 -1.12 0.51 117.51 119.30 3fga h ILE 505 Ca 0.03 -0.45 0.27 0.00 1.00 0.00 0.00 64.86 65.71 3fga h ILE 505 Cb 0.69 0.41 -0.14 0.00 -0.74 0.00 0.00 36.82 37.04 3fga h ILE 505 CO 0.04 0.20 0.40 0.78 0.00 0.00 0.00 178.15 179.57 3fga h ASN 506 N 0.80 0.28 0.13 1.72 -0.26 -1.06 -1.49 115.58 115.70 3fga h ASN 506 Ca 0.21 0.19 -0.24 0.00 -0.56 0.00 0.00 56.30 55.89 3fga h ASN 506 Cb 0.02 0.19 0.01 0.00 -1.06 0.00 0.00 38.32 37.48 3fga h ASN 506 CO -0.04 -0.11 -1.19 0.58 -1.06 0.00 0.00 177.43 175.61 3fga h VAL 507 N 0.30 1.22 0.00 2.81 2.07 -1.32 -3.38 116.25 117.95 3fga h VAL 507 Ca 0.63 -2.46 -0.12 0.00 0.82 0.00 0.00 66.70 65.58 3fga h VAL 507 Cb 1.33 2.90 -0.02 0.00 -1.52 0.00 0.00 31.29 33.98 3fga h VAL 507 CO -0.61 0.71 -0.55 -0.07 0.02 0.00 0.00 177.57 177.07 3fga h LEU 508 N -0.33 0.00 -1.17 2.57 3.38 -0.50 -3.01 115.31 116.26 3fga h LEU 508 Ca -0.24 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.78 3fga h LEU 508 Cb 1.72 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.42 3fga h LEU 508 CO 0.10 0.55 0.57 0.77 0.09 0.00 0.00 178.44 180.52 3fga h SER 509 N 0.00 0.91 0.00 -0.43 4.64 -1.45 -1.86 113.55 115.36 3fga h SER 509 Ca -0.01 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3fga h SER 509 Cb 1.02 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 3fga h SER 509 CO 0.07 0.61 0.28 -0.33 -0.87 0.00 0.00 176.83 176.59 3fga h GLU 510 N 1.05 0.00 0.00 4.77 5.08 -1.72 -3.13 114.58 120.63 3fga h GLU 510 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 3fga h GLU 510 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3fga h GLU 510 CO -0.12 0.00 0.00 1.33 -1.00 0.00 0.00 179.01 179.22 3fga n VAL 511 N -2.73 0.00 0.41 3.13 0.24 -0.99 -4.78 118.33 113.61 3fga n VAL 511 Ca -0.02 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.39 3fga n VAL 511 Cb 0.32 1.54 -0.01 0.00 -1.47 0.00 0.00 33.84 34.22 3fga n VAL 511 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3fga n GLY 513 N 1.32 -1.27 0.25 0.00 0.00 -1.24 -4.35 105.19 99.90 3fga n GLY 513 Ca 0.01 -1.59 0.01 0.00 0.00 0.00 0.00 46.02 44.45 3fga n GLY 513 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3fga h GLN 514 N 0.00 0.05 0.64 1.61 4.15 -1.88 -2.62 115.11 117.05 3fga h GLN 514 Ca 0.00 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.39 3fga h GLN 514 Cb 0.00 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 3fga h GLN 514 CO 0.00 0.04 -0.45 -0.44 -1.93 0.00 0.00 178.83 176.05 3fga h ASP 515 N 0.05 -1.16 -0.66 -0.69 3.32 -1.92 -1.11 116.42 114.25 3fga h ASP 515 Ca 0.33 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.45 3fga h ASP 515 Cb 0.53 0.36 -0.03 0.00 0.22 0.00 0.00 39.33 40.41 3fga h ASP 515 CO -0.61 -0.66 0.38 0.40 -1.72 0.00 0.00 179.24 177.03 3fga h ILE 516 N -1.04 1.20 0.09 0.35 5.03 -1.74 -0.71 117.51 120.70 3fga h ILE 516 Ca -0.08 -0.47 0.01 0.00 -0.12 0.00 0.00 64.86 64.20 3fga h ILE 516 Cb 0.86 0.31 -0.01 0.00 -3.03 0.00 0.00 36.82 34.95 3fga h ILE 516 CO 0.04 0.21 -0.11 0.74 -0.68 0.00 0.00 178.15 178.36 3fga h THR 517 N 0.90 0.75 -0.40 -0.27 2.02 -1.36 0.16 112.91 114.72 3fga h THR 517 Ca 0.24 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.36 3fga h THR 517 Cb 0.00 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 3fga h THR 517 CO -0.04 0.00 0.02 0.74 0.37 0.00 0.00 175.52 176.61 3fga h THR 518 N -0.23 1.26 0.25 3.16 2.02 -0.96 0.51 112.91 118.92 3fga h THR 518 Ca 0.01 -0.97 -0.34 0.00 0.77 0.00 0.00 66.41 65.88 3fga h THR 518 Cb 0.23 1.11 0.04 0.00 -1.74 0.00 0.00 68.15 67.78 3fga h THR 518 CO -0.04 0.33 -1.49 0.50 0.37 0.00 0.00 175.52 175.19 3fga h LYS 519 N 0.52 0.53 0.00 6.66 3.64 -1.03 -3.39 116.57 123.49 3fga h LYS 519 Ca 0.11 -0.90 0.00 0.00 -1.27 0.00 0.00 60.65 58.59 3fga h LYS 519 Cb 0.45 0.34 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3fga h LYS 519 CO 0.02 1.43 -0.55 0.72 -2.27 0.00 0.00 179.45 178.79 3fga n HIS 520 N -3.70 0.00 -0.01 1.91 8.25 0.55 -4.73 115.22 117.49 3fga n HIS 520 Ca -0.17 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.25 3fga n HIS 520 Cb 1.10 -0.04 -0.01 0.00 1.12 0.00 0.00 29.99 32.16 3fga n HIS 520 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 3fga n MET 521 N -1.30 0.12 -0.32 -0.41 2.81 -0.63 -4.73 117.12 112.65 3fga n MET 521 Ca 0.00 0.05 0.13 0.00 -1.81 0.00 0.00 57.70 56.07 3fga n MET 521 Cb 0.10 -0.70 0.27 0.00 -0.71 0.00 0.00 33.22 32.18 3fga n MET 521 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 3fga h LEU 522 N -0.21 -0.40 -0.70 4.03 5.85 -1.13 -1.18 115.31 121.57 3fga h LEU 522 Ca -0.08 0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.99 3fga h LEU 522 Cb 0.71 0.44 -0.07 0.00 0.37 0.00 0.00 40.66 42.11 3fga h LEU 522 CO -0.05 -0.31 0.35 -0.65 -0.34 0.00 0.00 178.44 177.45 3fga h PRO 523 N 0.05 0.59 -0.70 5.25 0.11 -1.84 -0.44 132.00 135.01 3fga h PRO 523 Ca 0.57 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.63 3fga h PRO 523 Cb 1.14 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.09 3fga h PRO 523 CO -0.85 0.39 0.39 1.15 -0.21 0.00 0.00 178.00 178.87 3fga h THR 524 N 0.61 1.21 -0.41 -1.15 2.02 -1.51 -2.21 112.91 111.47 3fga h THR 524 Ca 0.34 -0.52 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 3fga h THR 524 Cb 0.35 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 3fga h THR 524 CO -0.26 0.23 0.24 0.58 0.37 0.00 0.00 175.52 176.68 3fga h VAL 525 N 0.96 1.14 -0.15 3.16 2.07 -0.97 -2.49 116.25 119.96 3fga h VAL 525 Ca 0.25 -0.32 -0.09 0.00 0.82 0.00 0.00 66.70 67.35 3fga h VAL 525 Cb 0.02 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3fga h VAL 525 CO -0.04 0.14 -0.30 -0.07 0.02 0.00 0.00 177.57 177.31 3fga h LEU 526 N 0.54 0.30 -0.82 2.57 3.38 -0.97 -2.38 115.31 117.93 3fga h LEU 526 Ca 0.15 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 3fga h LEU 526 Cb 0.01 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3fga h LEU 526 CO -0.03 0.60 -0.33 0.03 0.09 0.00 0.00 178.44 178.80 3fga h ARG 527 N 0.26 0.50 0.00 1.13 3.08 -1.20 -2.98 114.38 115.17 3fga h ARG 527 Ca 0.04 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 3fga h ARG 527 Cb 0.67 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 3fga h ARG 527 CO 0.05 0.77 -0.06 0.52 -1.07 0.00 0.00 179.97 180.18 3fga h MET 528 N 0.42 0.00 0.00 0.04 2.86 -0.97 -2.55 114.93 114.73 3fga h MET 528 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 3fga h MET 528 Cb 0.78 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.44 3fga h MET 528 CO 0.06 0.06 0.41 0.00 1.06 0.00 0.00 176.91 178.50 3fga h ALA 529 N 1.94 1.38 -0.66 6.32 0.00 -1.43 0.67 119.26 127.49 3fga h ALA 529 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 3fga h ALA 529 Cb 0.28 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 17.91 3fga h ALA 529 CO 0.01 -0.38 0.26 0.41 0.00 0.00 0.00 179.25 179.55 3fga n GLY 530 N -1.27 4.25 3.76 0.00 0.00 -0.96 -4.90 105.19 106.07 3fga n GLY 530 Ca -0.01 -1.09 -0.39 0.00 0.00 0.00 0.00 46.02 44.53 3fga n GLY 530 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3fga s ASP 531 N -1.60 7.26 0.61 1.61 -1.08 0.23 -4.92 116.67 118.78 3fga s ASP 531 Ca 0.52 2.12 0.35 0.00 -0.52 0.00 0.00 52.55 55.01 3fga s ASP 531 Cb 0.43 -2.61 1.99 0.00 -1.46 0.00 0.00 42.92 41.27 3fga s ASP 531 CO 0.09 -0.14 2.27 -0.65 0.52 0.00 0.00 175.17 177.26 3fga h PRO 532 N 3.58 0.00 -5.10 4.34 0.11 -1.95 -3.42 132.00 129.56 3fga h PRO 532 Ca -0.47 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.01 3fga h PRO 532 Cb 1.21 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.11 3fga h PRO 532 CO 0.66 0.02 -0.61 0.08 -0.21 0.00 0.00 178.00 177.93 3fga s VAL 533 N -4.36 4.40 0.34 3.15 1.01 -1.26 -5.00 120.40 118.68 3fga s VAL 533 Ca -0.04 -0.15 0.10 0.00 0.00 0.00 0.00 61.98 61.88 3fga s VAL 533 Cb 0.14 -3.02 0.33 0.00 0.00 0.00 0.00 36.38 33.82 3fga s VAL 533 CO 0.50 0.40 1.79 0.00 0.00 0.00 0.00 175.10 177.79 3fga h ALA 534 N 7.56 1.84 -0.88 5.51 0.00 -2.00 -1.65 119.26 129.64 3fga h ALA 534 Ca -0.37 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3fga h ALA 534 Cb 1.18 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 3fga h ALA 534 CO 0.62 -0.20 0.53 -0.91 0.00 0.00 0.00 179.25 179.29 3fga h ASN 535 N 0.65 1.06 -0.46 0.00 4.21 -1.95 0.60 115.58 119.69 3fga h ASN 535 Ca 0.56 -0.06 -0.06 0.00 1.21 0.00 0.00 56.30 57.95 3fga h ASN 535 Cb 1.02 -0.27 -0.02 0.00 -1.12 0.00 0.00 38.32 37.93 3fga h ASN 535 CO -0.33 0.82 0.06 0.58 -1.29 0.00 0.00 177.43 177.27 3fga h VAL 536 N 1.22 1.25 0.23 2.81 2.07 -1.66 -2.92 116.25 119.25 3fga h VAL 536 Ca 0.32 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 3fga h VAL 536 Cb -0.05 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3fga h VAL 536 CO -0.06 0.33 -0.11 0.03 0.02 0.00 0.00 177.57 177.78 3fga h ARG 537 N 0.64 -0.30 0.00 1.57 3.08 -0.70 -1.97 114.38 116.69 3fga h ARG 537 Ca 0.14 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 3fga h ARG 537 Cb 0.41 0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.53 3fga h ARG 537 CO 0.01 -0.17 -0.01 0.27 -1.07 0.00 0.00 179.97 179.00 3fga h PHE 538 N -0.36 0.00 0.00 3.04 -5.15 -1.03 -1.31 116.94 112.13 3fga h PHE 538 Ca -0.03 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.62 3fga h PHE 538 Cb 0.27 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.43 3fga h PHE 538 CO -0.05 0.01 -0.56 -0.91 -2.00 0.00 0.00 178.31 174.81 3fga h ASN 539 N 0.00 0.00 -0.74 -0.68 2.35 -1.26 -1.58 115.58 113.67 3fga h ASN 539 Ca -0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 3fga h ASN 539 Cb 0.33 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.67 3fga h ASN 539 CO 0.00 0.56 0.38 0.58 -1.65 0.00 0.00 177.43 177.29 3fga h VAL 540 N 0.00 1.23 0.47 2.81 2.07 -0.49 0.23 116.25 122.57 3fga h VAL 540 Ca -0.01 -0.63 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 3fga h VAL 540 Cb 1.25 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 3fga h VAL 540 CO 0.07 0.27 -0.24 0.00 0.02 0.00 0.00 177.57 177.69 3fga h ALA 541 N 1.19 -0.65 -0.68 1.67 0.00 -1.35 -0.27 119.26 119.17 3fga h ALA 541 Ca 0.26 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.13 3fga h ALA 541 Cb 0.08 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 3fga h ALA 541 CO -0.04 -0.87 0.45 0.87 0.00 0.00 0.00 179.25 179.67 3fga h LYS 542 N -0.65 0.51 0.02 0.00 1.57 -1.07 -0.86 116.57 116.09 3fga h LYS 542 Ca -0.06 -0.03 -0.26 0.00 -1.87 0.00 0.00 60.65 58.42 3fga h LYS 542 Cb 0.51 -0.12 0.02 0.00 0.08 0.00 0.00 32.23 32.72 3fga h LYS 542 CO 0.09 0.34 -1.05 1.03 -0.57 0.00 0.00 179.45 179.29 3fga h SER 543 N 0.53 0.82 -0.48 0.86 0.87 -0.32 -2.26 113.55 113.57 3fga h SER 543 Ca 0.32 -0.67 -0.07 0.00 -1.23 0.00 0.00 61.79 60.14 3fga h SER 543 Cb 0.53 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.22 3fga h SER 543 CO -0.10 1.48 0.04 -0.07 -0.53 0.00 0.00 176.83 177.65 3fga h LEU 544 N 0.34 0.79 -0.45 2.23 3.38 -0.52 -1.25 115.31 119.84 3fga h LEU 544 Ca -0.13 -0.28 0.09 0.00 0.09 0.00 0.00 57.88 57.65 3fga h LEU 544 Cb 1.70 -0.21 -0.10 0.00 0.09 0.00 0.00 40.66 42.15 3fga h LEU 544 CO 0.20 0.87 -0.24 -0.61 0.09 0.00 0.00 178.44 178.75 3fga h GLN 545 N 0.67 -0.15 -0.24 1.13 4.15 -1.12 0.18 115.11 119.74 3fga h GLN 545 Ca 0.14 0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.53 3fga h GLN 545 Cb 0.45 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.16 3fga h GLN 545 CO 0.02 -0.10 -0.01 -0.22 -1.93 0.00 0.00 178.83 176.59 3fga h LYS 546 N -0.15 0.43 -0.00 1.69 1.63 -0.96 -3.00 116.57 116.19 3fga h LYS 546 Ca 0.21 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 3fga h LYS 546 Cb 0.48 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.08 3fga h LYS 546 CO -0.54 0.61 -0.31 0.44 -3.45 0.00 0.00 179.45 176.20 3fga n ILE 547 N -4.63 0.00 -0.19 2.00 -5.35 -0.51 -4.37 119.36 106.31 3fga n ILE 547 Ca -0.04 -0.04 -0.04 0.00 -0.27 0.00 0.00 62.75 62.36 3fga n ILE 547 Cb 0.25 0.14 0.03 0.00 -1.74 0.00 0.00 39.64 38.32 3fga n ILE 547 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3fga h GLY 548 N 4.98 0.12 1.86 3.28 0.00 -0.49 -1.99 103.07 110.83 3fga h GLY 548 Ca 0.00 0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.68 3fga h GLY 548 CO 0.00 -0.22 0.05 -2.55 0.00 0.00 0.00 176.54 173.82 3fga h PRO 549 N -0.11 0.00 0.00 4.80 0.11 -1.76 -2.44 132.00 132.60 3fga h PRO 549 Ca 0.25 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.36 3fga h PRO 549 Cb 0.51 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.62 3fga h PRO 549 CO -0.64 0.00 -0.01 0.82 -0.21 0.00 0.00 178.00 177.96 3fga h ILE 550 N 0.00 0.03 -2.95 4.15 1.08 -1.66 -3.46 117.51 114.71 3fga h ILE 550 Ca 0.03 -0.39 -0.52 0.00 -0.39 0.00 0.00 64.86 63.59 3fga h ILE 550 Cb 0.13 1.38 -0.01 0.00 -3.07 0.00 0.00 36.82 35.24 3fga h ILE 550 CO -0.00 0.01 -0.25 -0.76 -0.69 0.00 0.00 178.15 176.46 3fga s LEU 551 N -6.22 4.15 0.32 1.44 1.43 -0.92 -4.50 118.68 114.38 3fga s LEU 551 Ca -0.01 0.51 -0.29 0.00 -1.03 0.00 0.00 54.13 53.32 3fga s LEU 551 Cb 0.10 -3.31 -0.10 0.00 0.03 0.00 0.00 46.19 42.91 3fga s LEU 551 CO 0.51 -0.12 1.28 -0.62 0.23 0.00 0.00 176.35 177.63 3fga s ASP 552 N -3.27 6.83 0.58 2.29 -1.08 -1.26 -4.83 116.67 115.93 3fga s ASP 552 Ca 0.40 2.63 0.28 0.00 -0.52 0.00 0.00 52.55 55.35 3fga s ASP 552 Cb -0.11 -2.65 1.51 0.00 -1.46 0.00 0.00 42.92 40.22 3fga s ASP 552 CO 0.30 -0.49 1.97 -1.13 0.52 0.00 0.00 175.17 176.34 3fga h ASN 553 N 3.49 0.00 -0.28 -0.34 -1.24 -1.97 0.43 115.58 115.67 3fga h ASN 553 Ca -0.49 0.00 -0.10 0.00 0.71 0.00 0.00 56.30 56.42 3fga h ASN 553 Cb 1.22 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.27 3fga h ASN 553 CO 0.66 0.00 -0.23 0.77 -1.29 0.00 0.00 177.43 177.34 3fga h SER 554 N 0.00 0.68 0.07 1.15 4.64 -1.98 -1.35 113.55 116.76 3fga h SER 554 Ca 0.19 -0.45 -0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3fga h SER 554 Cb 0.98 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 3fga h SER 554 CO -0.00 0.99 -0.04 0.74 -0.87 0.00 0.00 176.83 177.65 3fga h THR 555 N 0.37 1.08 -0.92 2.95 2.02 -1.45 -1.22 112.91 115.75 3fga h THR 555 Ca 0.05 -0.53 0.24 0.00 0.77 0.00 0.00 66.41 66.94 3fga h THR 555 Cb 0.78 1.43 -0.13 0.00 -1.74 0.00 0.00 68.15 68.48 3fga h THR 555 CO 0.06 0.13 0.42 0.25 0.37 0.00 0.00 175.52 176.75 3fga h LEU 556 N -0.34 0.35 0.14 2.58 5.85 -1.01 -1.20 115.31 121.68 3fga h LEU 556 Ca -0.01 0.16 -0.31 0.00 0.84 0.00 0.00 57.88 58.56 3fga h LEU 556 Cb 0.29 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 3fga h LEU 556 CO 0.02 -0.03 -1.54 -0.61 -0.34 0.00 0.00 178.44 175.94 3fga h GLN 557 N 0.38 0.29 0.00 1.25 5.75 -1.01 -1.31 115.11 120.47 3fga h GLN 557 Ca 0.59 -0.50 -0.06 0.00 -0.15 0.00 0.00 58.65 58.53 3fga h GLN 557 Cb 1.17 0.19 -0.01 0.00 1.07 0.00 0.00 27.48 29.90 3fga h GLN 557 CO -0.55 1.18 -1.47 -1.13 -2.65 0.00 0.00 178.83 174.20 3fga n SER 558 N -3.50 0.54 -0.01 -0.69 3.41 -0.48 -4.44 113.62 108.45 3fga n SER 558 Ca -0.17 0.22 -0.05 0.00 -0.26 0.00 0.00 58.87 58.61 3fga n SER 558 Cb 1.05 0.89 -0.02 0.00 -0.26 0.00 0.00 64.21 65.88 3fga n SER 558 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3fga n GLU 559 N -2.60 0.14 0.18 4.33 1.02 -0.47 -4.72 120.64 118.53 3fga n GLU 559 Ca -0.05 0.06 -0.13 0.00 -0.02 0.00 0.00 57.16 57.02 3fga n GLU 559 Cb 0.65 -0.75 -0.07 0.00 -0.02 0.00 0.00 31.44 31.25 3fga n GLU 559 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3fga h VAL 560 N -0.26 0.50 -0.65 2.62 2.07 -1.40 -3.31 116.25 115.82 3fga h VAL 560 Ca -0.09 -0.62 0.12 0.00 0.82 0.00 0.00 66.70 66.94 3fga h VAL 560 Cb 0.71 0.75 -0.12 0.00 -1.52 0.00 0.00 31.29 31.10 3fga h VAL 560 CO -0.06 0.09 -0.24 0.50 0.02 0.00 0.00 177.57 177.88 3fga h LYS 561 N -0.91 -0.07 -0.31 1.57 3.64 -1.46 -1.82 116.57 117.21 3fga h LYS 561 Ca -0.05 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.38 3fga h LYS 561 Cb 0.54 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.33 3fga h LYS 561 CO 0.08 -0.05 0.04 -1.35 -2.27 0.00 0.00 179.45 175.90 3fga h PRO 562 N -0.07 0.13 -0.36 1.90 0.11 -1.81 -1.21 132.00 130.69 3fga h PRO 562 Ca 0.29 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.41 3fga h PRO 562 Cb 0.53 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.58 3fga h PRO 562 CO -0.70 0.09 0.21 0.82 -0.21 0.00 0.00 178.00 178.21 3fga h ILE 563 N 0.14 1.04 -0.54 4.15 1.08 -1.50 0.11 117.51 121.98 3fga h ILE 563 Ca 0.15 -0.15 0.04 0.00 -0.39 0.00 0.00 64.86 64.51 3fga h ILE 563 Cb 0.18 0.57 -0.04 0.00 -3.07 0.00 0.00 36.82 34.45 3fga h ILE 563 CO -0.22 0.08 0.30 -0.07 -0.69 0.00 0.00 178.15 177.55 3fga h LEU 564 N 0.43 0.45 -0.71 1.44 3.38 -1.11 -1.55 115.31 117.64 3fga h LEU 564 Ca 0.14 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 3fga h LEU 564 Cb 0.00 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3fga h LEU 564 CO -0.07 0.31 0.38 -0.33 0.09 0.00 0.00 178.44 178.83 3fga h GLU 565 N 0.58 1.00 -0.99 1.13 5.08 -0.77 -1.85 114.58 118.75 3fga h GLU 565 Ca 0.23 -0.12 0.10 0.00 -1.00 0.00 0.00 59.36 58.57 3fga h GLU 565 Cb 0.10 -0.19 -0.08 0.00 0.50 0.00 0.00 28.75 29.08 3fga h GLU 565 CO -0.14 0.75 0.63 -0.22 -1.00 0.00 0.00 179.01 179.04 3fga h LYS 566 N 0.98 1.02 0.00 2.33 1.63 -0.37 -2.20 116.57 119.96 3fga h LYS 566 Ca 0.25 -0.06 -0.09 0.00 -0.85 0.00 0.00 60.65 59.90 3fga h LYS 566 Cb 0.05 -0.23 -0.01 0.00 -0.60 0.00 0.00 32.23 31.43 3fga h LYS 566 CO -0.04 0.68 -0.43 -0.07 -3.45 0.00 0.00 179.45 176.14 3fga h LEU 567 N 1.05 0.00 -1.42 5.20 3.38 -0.52 -2.35 115.31 120.65 3fga h LEU 567 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.43 3fga h LEU 567 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3fga h LEU 567 CO -0.22 0.43 0.00 0.71 0.09 0.00 0.00 178.44 179.45 3fga h THR 568 N 0.00 0.00 -0.22 0.22 1.35 -0.71 -0.40 112.91 113.15 3fga h THR 568 Ca -0.00 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.70 3fga h THR 568 Cb 0.96 0.87 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3fga h THR 568 CO 0.06 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.33 3fga n GLN 569 N -2.49 1.98 -1.93 4.72 1.13 -0.89 -4.83 117.38 115.07 3fga n GLN 569 Ca -0.00 -1.47 -0.38 0.00 -1.94 0.00 0.00 57.00 53.21 3fga n GLN 569 Cb 0.15 -1.43 0.02 0.00 0.11 0.00 0.00 30.24 29.09 3fga n GLN 569 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3fga s ASP 570 N -1.57 5.56 0.26 1.08 2.15 -0.16 -4.91 116.67 119.09 3fga s ASP 570 Ca 0.34 2.63 0.22 0.00 0.43 0.00 0.00 52.55 56.16 3fga s ASP 570 Cb 0.19 -2.63 0.99 0.00 -0.30 0.00 0.00 42.92 41.18 3fga s ASP 570 CO 0.28 -1.36 1.66 0.00 -0.17 0.00 0.00 175.17 175.58 3fga n GLN 571 N -0.84 0.16 -4.19 4.34 10.64 -1.26 -4.72 117.38 121.51 3fga n GLN 571 Ca 0.09 0.49 -0.34 0.00 -1.83 0.00 0.00 57.00 55.41 3fga n GLN 571 Cb 0.46 -1.87 -0.13 0.00 -0.86 0.00 0.00 30.24 27.83 3fga n GLN 571 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 3fga s ASP 572 N -4.07 4.54 0.33 2.61 -1.08 -1.26 -5.02 116.67 112.72 3fga s ASP 572 Ca 0.02 -0.26 0.08 0.00 -0.52 0.00 0.00 52.55 51.87 3fga s ASP 572 Cb 0.08 -1.76 0.80 0.00 -1.46 0.00 0.00 42.92 40.58 3fga s ASP 572 CO 0.31 0.07 1.80 1.62 0.52 0.00 0.00 175.17 179.49 3fga h VAL 573 N 5.44 0.72 0.00 1.11 3.04 -2.00 -1.69 116.25 122.88 3fga h VAL 573 Ca -0.35 -0.24 -0.19 0.00 -1.01 0.00 0.00 66.70 64.91 3fga h VAL 573 Cb 1.18 -0.05 -0.02 0.00 -2.01 0.00 0.00 31.29 30.40 3fga h VAL 573 CO 0.60 0.13 -0.85 0.44 -1.01 0.00 0.00 177.57 176.89 3fga h ASP 574 N 0.71 0.18 -0.14 3.17 3.32 -1.97 -1.49 116.42 120.19 3fga h ASP 574 Ca 0.55 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.42 3fga h ASP 574 Cb 0.92 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.41 3fga h ASP 574 CO -0.32 0.94 -0.04 0.58 -1.72 0.00 0.00 179.24 178.68 3fga h VAL 575 N 0.08 1.29 -0.97 -1.35 2.07 -1.66 -2.38 116.25 113.34 3fga h VAL 575 Ca -0.03 -1.00 0.03 0.00 0.82 0.00 0.00 66.70 66.52 3fga h VAL 575 Cb 1.47 1.66 -0.05 0.00 -1.52 0.00 0.00 31.29 32.84 3fga h VAL 575 CO 0.12 0.29 0.63 0.50 0.02 0.00 0.00 177.57 179.14 3fga h LYS 576 N -0.03 1.20 -0.24 1.57 3.64 -1.34 -1.26 116.57 120.12 3fga h LYS 576 Ca 0.04 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 3fga h LYS 576 Cb 0.47 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3fga h LYS 576 CO 0.02 0.80 -0.05 -0.92 -2.27 0.00 0.00 179.45 177.02 3fga h TYR 577 N 1.24 0.52 0.00 1.91 3.20 -1.24 -2.18 116.97 120.42 3fga h TYR 577 Ca 0.38 -0.11 -0.08 0.00 3.14 0.00 0.00 58.73 62.06 3fga h TYR 577 Cb -0.03 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 3fga h TYR 577 CO -0.01 0.68 -0.37 0.74 -1.64 0.00 0.00 178.16 177.57 3fga h PHE 578 N 0.21 0.00 0.53 -3.82 0.04 -1.09 -1.82 116.94 110.99 3fga h PHE 578 Ca 0.06 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.81 3fga h PHE 578 Cb 0.51 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.67 3fga h PHE 578 CO 0.05 0.37 -0.25 0.00 -0.60 0.00 0.00 178.31 177.87 3fga h ALA 579 N 1.63 -0.71 -1.16 2.45 0.00 -1.22 -1.80 119.26 118.45 3fga h ALA 579 Ca -0.00 -0.19 0.33 0.00 0.00 0.00 0.00 54.91 55.05 3fga h ALA 579 Cb 1.08 0.28 -0.10 0.00 0.00 0.00 0.00 17.79 19.04 3fga h ALA 579 CO 0.05 -0.71 0.76 1.96 0.00 0.00 0.00 179.25 181.30 3fga h GLN 580 N -1.09 0.24 -0.10 0.00 4.20 -1.34 -0.12 115.11 116.89 3fga h GLN 580 Ca -0.07 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.56 3fga h GLN 580 Cb 0.61 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.33 3fga h GLN 580 CO 0.12 0.16 -0.16 1.49 -0.67 0.00 0.00 178.83 179.77 3fga h GLU 581 N 0.25 0.30 -0.85 1.46 4.57 -1.25 -2.70 114.58 116.35 3fga h GLU 581 Ca 0.67 -0.18 -0.02 0.00 -1.18 0.00 0.00 59.36 58.65 3fga h GLU 581 Cb 1.96 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 30.53 3fga h GLU 581 CO -0.31 0.75 0.44 0.00 -1.18 0.00 0.00 179.01 178.71 3fga h ALA 582 N 0.54 1.17 -0.62 2.92 0.00 -0.16 -1.67 119.26 121.44 3fga h ALA 582 Ca 0.01 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 3fga h ALA 582 Cb 0.72 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3fga h ALA 582 CO 0.04 0.65 0.15 -0.07 0.00 0.00 0.00 179.25 180.02 3fga h LEU 583 N 1.21 0.92 0.30 0.00 3.38 -1.28 -0.78 115.31 119.05 3fga h LEU 583 Ca 0.30 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3fga h LEU 583 Cb 0.07 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.58 3fga h LEU 583 CO -0.04 0.89 -0.14 0.74 0.09 0.00 0.00 178.44 179.97 3fga h THR 584 N 0.93 0.73 -0.57 0.22 2.02 -1.13 0.21 112.91 115.33 3fga h THR 584 Ca 0.20 -0.35 -0.03 0.00 0.77 0.00 0.00 66.41 67.00 3fga h THR 584 Cb 0.33 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 3fga h THR 584 CO -0.00 0.07 0.22 0.58 0.37 0.00 0.00 175.52 176.76 3fga h VAL 585 N -0.59 1.23 0.00 3.16 2.07 -1.17 -1.05 116.25 119.90 3fga h VAL 585 Ca -0.04 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.77 3fga h VAL 585 Cb 0.43 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 3fga h VAL 585 CO 0.07 0.27 0.00 0.18 0.02 0.00 0.00 177.57 178.11 3fga n LEU 586 N -4.48 0.00 -3.63 2.57 4.77 -0.31 -4.91 117.00 111.01 3fga n LEU 586 Ca 0.03 0.21 -0.22 0.00 -0.03 0.00 0.00 56.01 55.99 3fga n LEU 586 Cb 0.17 -0.21 0.06 0.00 -2.33 0.00 0.00 43.42 41.11 3fga n LEU 586 CO 0.39 -0.01 0.09 -1.20 -1.33 0.00 0.00 177.39 175.33 3fga n SER 587 N -1.21 -3.25 -0.72 -1.43 7.64 -0.40 -4.89 113.62 109.36 3fga n SER 587 Ca 0.16 -0.69 0.09 0.00 1.01 0.00 0.00 58.87 59.44 3fga n SER 587 Cb 0.20 -4.57 0.08 0.00 -1.01 0.00 0.00 64.21 58.90 3fga n SER 587 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3fga n LEU 588 N -4.47 2.51 -0.88 -3.43 4.77 0.65 -5.03 117.00 111.12 3fga n LEU 588 Ca -0.17 -1.03 0.11 0.00 -0.03 0.00 0.00 56.01 54.90 3fga n LEU 588 Cb 0.62 -0.01 0.09 0.00 -2.33 0.00 0.00 43.42 41.79 3fga n LEU 588 CO 0.67 0.45 0.60 0.00 -1.33 0.00 0.00 177.39 177.77